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Indolecarboxylic acids
Description:
Compounds containing a carboxylic acid group linked to an indole.
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(1-(tert-Butoxycarbonyl)-1H-indol-4-yl)boronic acidCas Number: 2102451-30-7 Compound CID: 86280337Formula: C13H16BNO4 Molecular Weight: 261.079IUPAC Name: [1-[(2-methylpropan-2-yl)oxycarbonyl]indol-4-yl]boronic acidSMILES: B(C1=C2C=CN(C2=CC=C1)C(=O)OC(C)(C)C)(O)OInChIKey: JFCFJRCULIWLNL-UHFFFAOYSA-NInChI: InChI=1S/C13H16BNO4/c1-13(2,3)19-12(16)15-8-7-9-10(14(17)18)5-4-6-11(9)15/h4-8,17-18H,1-3H3 -
1-tert-Butyl 4-methyl 1H-indole-1，4-dicarboxylateCas Number: 220499-11-6 Compound CID: 12148523Formula: C15H17NO4 Molecular Weight: 275.31IUPAC Name: 1-O-tert-butyl 4-O-methyl indole-1,4-dicarboxylateSMILES: CC(C)(C)OC(=O)N1C=CC2=C(C=CC=C21)C(=O)OCInChIKey: HLGNJZVTHXMEHU-UHFFFAOYSA-NInChI: InChI=1S/C15H17NO4/c1-15(2,3)20-14(18)16-9-8-10-11(13(17)19-4)6-5-7-12(10)16/h5-9H,1-4H3
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1H-Indole-2，5-dicarboxylic acidCas Number: 117140-77-9 Compound CID: 4308326Formula: C10H7NO4 Molecular Weight: 205.17IUPAC Name: 1H-indole-2,5-dicarboxylic acidSMILES: C1=CC2=C(C=C1C(=O)O)C=C(N2)C(=O)OInChIKey: MUABQYJAPOQWCH-UHFFFAOYSA-NInChI: InChI=1S/C10H7NO4/c12-9(13)5-1-2-7-6(3-5)4-8(11-7)10(14)15/h1-4,11H,(H,12,13)(H,14,15)
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1-Boc-7-methylindole-3-boronic acid pinacol esterCas Number: 1256360-03-8 Compound CID: 53217223Formula: C20H28BNO4 Molecular Weight: 357.26IUPAC Name: tert-butyl 7-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indole-1-carboxylateSMILES: B1(OC(C(O1)(C)C)(C)C)C2=CN(C3=C(C=CC=C23)C)C(=O)OC(C)(C)CInChIKey: HXLUJYZTBWUMMP-UHFFFAOYSA-NInChI: InChI=1S/C20H28BNO4/c1-13-10-9-11-14-15(21-25-19(5,6)20(7,8)26-21)12-22(16(13)14)17(23)24-18(2,3)4/h9-12H,1-8H3
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1-Boc-5-formylindolineCas Number: 879887-32-8 Compound CID: 21865437Formula: C14H17NO3 Molecular Weight: 247.29IUPAC Name: tert-butyl 5-formyl-2,3-dihydroindole-1-carboxylateSMILES: CC(C)(C)OC(=O)N1CCC2=C1C=CC(=C2)C=OInChIKey: BXALJGGFHGKPIM-UHFFFAOYSA-NInChI: InChI=1S/C14H17NO3/c1-14(2,3)18-13(17)15-7-6-11-8-10(9-16)4-5-12(11)15/h4-5,8-9H,6-7H2,1-3H3
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1-Boc-6-methylindole-3-boronic acid pinacol esterCas Number: 1256359-86-0 Compound CID: 53217186Formula: C20H28BNO4 Molecular Weight: 357.26IUPAC Name: tert-butyl 6-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indole-1-carboxylateSMILES: B1(OC(C(O1)(C)C)(C)C)C2=CN(C3=C2C=CC(=C3)C)C(=O)OC(C)(C)CInChIKey: BUUCDWYNFVFACT-UHFFFAOYSA-NInChI: InChI=1S/C20H28BNO4/c1-13-9-10-14-15(21-25-19(5,6)20(7,8)26-21)12-22(16(14)11-13)17(23)24-18(2,3)4/h9-12H,1-8H3
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1-Boc-4-ChloroindoleCas Number: 129822-46-4 Compound CID: 11402496Formula: C13H14ClNO2 Molecular Weight: 251.71IUPAC Name: tert-butyl 4-chloroindole-1-carboxylateSMILES: CC(C)(C)OC(=O)N1C=CC2=C1C=CC=C2ClInChIKey: SNYOMIGRAXEOBR-UHFFFAOYSA-NInChI: InChI=1S/C13H14ClNO2/c1-13(2,3)17-12(16)15-8-7-9-10(14)5-4-6-11(9)15/h4-8H,1-3H3
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1-Boc-6-methoxyindole-3-boronic acid pinacol esterCas Number: 1256360-00-5 Compound CID: 53217219Formula: C20H28BNO5 Molecular Weight: 373.26IUPAC Name: tert-butyl 6-methoxy-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indole-1-carboxylateSMILES: B1(OC(C(O1)(C)C)(C)C)C2=CN(C3=C2C=CC(=C3)OC)C(=O)OC(C)(C)CInChIKey: NEVYMHCTIQBRQU-UHFFFAOYSA-NInChI: InChI=1S/C20H28BNO5/c1-18(2,3)25-17(23)22-12-15(14-10-9-13(24-8)11-16(14)22)21-26-19(4,5)20(6,7)27-21/h9-12H,1-8H3
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1-Boc-4-formylindolineCas Number: 1207194-48-6 Compound CID: 53393788Formula: C14H17NO3 Molecular Weight: 247.29IUPAC Name: tert-butyl 4-formyl-2,3-dihydroindole-1-carboxylateSMILES: CC(C)(C)OC(=O)N1CCC2=C(C=CC=C21)C=OInChIKey: FEAIDQMPFVVRKA-UHFFFAOYSA-NInChI: InChI=1S/C14H17NO3/c1-14(2,3)18-13(17)15-8-7-11-10(9-16)5-4-6-12(11)15/h4-6,9H,7-8H2,1-3H3
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1-(tert-Butoxycarbonyl)indoline-6-carboxylic acidCas Number: 208772-41-2 Compound CID: 18354849Formula: C14H17NO4 Molecular Weight: 263.29IUPAC Name: 1-[(2-methylpropan-2-yl)oxycarbonyl]-2,3-dihydroindole-6-carboxylic acidSMILES: CC(C)(C)OC(=O)N1CCC2=C1C=C(C=C2)C(=O)OInChIKey: QAODAHHBCGSYTN-UHFFFAOYSA-NInChI: InChI=1S/C14H17NO4/c1-14(2,3)19-13(18)15-7-6-9-4-5-10(12(16)17)8-11(9)15/h4-5,8H,6-7H2,1-3H3,(H,16,17)
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1-Acetylindoline-5-carboxylic AcidCas Number: 153247-93-9 Compound CID: 5295547Formula: C11H11NO3 Molecular Weight: 205.21IUPAC Name: 1-acetyl-2,3-dihydroindole-5-carboxylic acidSMILES: CC(=O)N1CCC2=C1C=CC(=C2)C(=O)OInChIKey: KRXHHESVJTVORG-UHFFFAOYSA-NInChI: InChI=1S/C11H11NO3/c1-7(13)12-5-4-8-6-9(11(14)15)2-3-10(8)12/h2-3,6H,4-5H2,1H3,(H,14,15)
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1-(tert-Butoxycarbonyl)-1H-indole-4-carboxylic acidCas Number: 848444-79-1 Compound CID: 49758850Formula: C14H15NO4 Molecular Weight: 261.28IUPAC Name: 1-[(2-methylpropan-2-yl)oxycarbonyl]indole-4-carboxylic acidSMILES: CC(C)(C)OC(=O)N1C=CC2=C(C=CC=C21)C(=O)OInChIKey: HQSFITLRCKIRLE-UHFFFAOYSA-NInChI: InChI=1S/C14H15NO4/c1-14(2,3)19-13(18)15-8-7-9-10(12(16)17)5-4-6-11(9)15/h4-8H,1-3H3,(H,16,17)
