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Indoles
Description:
Compounds containing an indole moiety, which consists of pyrrole ring fused to benzene to form 2,3-benzopyrrole.
Ancestors:
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(6-Chloro-1H-indol-2-yl)methanolCas Number: 53590-58-2 Compound CID: 16115151IUPAC Name: (6-chloro-1H-indol-2-yl)methanolSMILES: C1=CC2=C(C=C1Cl)NC(=C2)COInChIKey: QHPJEFKYIRFYMZ-UHFFFAOYSA-NInChI: InChI=1S/C9H8ClNO/c10-7-2-1-6-3-8(5-12)11-9(6)4-7/h1-4,11-12H,5H2 -
(5-Methoxy-1H-Indol-3-Yl)MethanamineCas Number: 60523-82-2 Compound CID: 14702424IUPAC Name: (5-methoxy-1H-indol-3-yl)methanamineSMILES: COC1=CC2=C(C=C1)NC=C2CNInChIKey: CAHOMULUOHSWPI-UHFFFAOYSA-NInChI: InChI=1S/C10H12N2O/c1-13-8-2-3-10-9(4-8)7(5-11)6-12-10/h2-4,6,12H,5,11H2,1H3
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Isopropyl 1，1-Dimethyl-1，2，3，6-Tetrahydroazepino[4，5-B]Indole-5-CarboxylateCas Number: 942145-77-9 Compound CID: 25223263IUPAC Name: propan-2-yl 1,1-dimethyl-3,6-dihydro-2H-azepino[4,5-b]indole-5-carboxylateSMILES: CC(C)OC(=O)C1=CNCC(C2=C1NC3=CC=CC=C32)(C)CInChIKey: LWOPKUFMTHTYQL-UHFFFAOYSA-NInChI: InChI=1S/C18H22N2O2/c1-11(2)22-17(21)13-9-19-10-18(3,4)15-12-7-5-6-8-14(12)20-16(13)15/h5-9,11,19-20H,10H2,1-4H3
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Indole-3-thio CarboxamideCas Number: 59108-90-6 Compound CID: 12276962Formula: C9H8N2S Molecular Weight: 176.24IUPAC Name: 1H-indole-3-carbothioamideSMILES: C1=CC=C2C(=C1)C(=CN2)C(=S)NInChIKey: PPWNZMJWESSLGE-UHFFFAOYSA-NInChI: InChI=1S/C9H8N2S/c10-9(12)7-5-11-8-4-2-1-3-6(7)8/h1-5,11H,(H2,10,12)
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Ethyl 6-amino-1H-indole-7-carboxylateCas Number: 174311-79-6 Compound CID: 10822051Formula: C11H12N2O2 Molecular Weight: 204.22IUPAC Name: ethyl 6-amino-1H-indole-7-carboxylateSMILES: CCOC(=O)C1=C(C=CC2=C1NC=C2)NInChIKey: URJOBQJGQMZSTN-UHFFFAOYSA-NInChI: InChI=1S/C11H12N2O2/c1-2-15-11(14)9-8(12)4-3-7-5-6-13-10(7)9/h3-6,13H,2,12H2,1H3
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Caulilexin CCas Number: 30536-48-2 Compound CID: 11954881Formula: C11H10N2O Molecular Weight: 186.21IUPAC Name: 2-(1-methoxyindol-3-yl)acetonitrileSMILES: CON1C=C(C2=CC=CC=C21)CC#NInChIKey: LIJIPBYXIXTNLE-UHFFFAOYSA-NInChI: InChI=1S/C11H10N2O/c1-14-13-8-9(6-7-12)10-4-2-3-5-11(10)13/h2-5,8H,6H2,1H3
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7-Methyl-2-(4，4，5，5-tetramethyl-1，3，2-dioxaborolan-2-yl)-1H-indoleCas Number: 912331-68-1 Compound CID: 53216783Formula: C15H20BNO2 Molecular Weight: 257.14IUPAC Name: 7-methyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indoleSMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC3=CC=CC(=C3N2)CInChIKey: AZNAYTQOYNEGPL-UHFFFAOYSA-NInChI: InChI=1S/C15H20BNO2/c1-10-7-6-8-11-9-12(17-13(10)11)16-18-14(2,3)15(4,5)19-16/h6-9,17H,1-5H3
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7-Methoxy-2-(4，4，5，5-tetramethyl-1，3，2-dioxaborolan-2-yl)-1H-indoleCas Number: 1072812-69-1 Compound CID: 53216776Formula: C15H20BNO3 Molecular Weight: 273.14IUPAC Name: 7-methoxy-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indoleSMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(N2)C(=CC=C3)OCInChIKey: PUMBCQFXUXKTHQ-UHFFFAOYSA-NInChI: InChI=1S/C15H20BNO3/c1-14(2)15(3,4)20-16(19-14)12-9-10-7-6-8-11(18-5)13(10)17-12/h6-9,17H,1-5H3
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7-Bromo-1H-indole-2-carbaldehydeCas Number: 53590-66-2 Compound CID: 44720801Formula: C9H6BrNO Molecular Weight: 224.05IUPAC Name: 7-bromo-1H-indole-2-carbaldehydeSMILES: C1=CC2=C(C(=C1)Br)NC(=C2)C=OInChIKey: LVCLAISVMPPTLL-UHFFFAOYSA-NInChI: InChI=1S/C9H6BrNO/c10-8-3-1-2-6-4-7(5-12)11-9(6)8/h1-5,11H
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7-Bromo-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indoleCas Number: 1072812-23-7 Compound CID: 53217117Formula: C14H17BBrNO2 Molecular Weight: 322.02IUPAC Name: 7-bromo-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indoleSMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(N2)C(=CC=C3)BrInChIKey: KGWJGQUTNNLURY-UHFFFAOYSA-NInChI: InChI=1S/C14H17BBrNO2/c1-13(2)14(3,4)19-15(18-13)11-8-9-6-5-7-10(16)12(9)17-11/h5-8,17H,1-4H3
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7-(Trifluoromethoxy)-1H-indoleCas Number: 396075-91-5 Compound CID: 22338244Formula: C9H6F3NO Molecular Weight: 201.15IUPAC Name: 7-(trifluoromethoxy)-1H-indoleSMILES: C1=CC2=C(C(=C1)OC(F)(F)F)NC=C2InChIKey: VWWNXBVHASKIKY-UHFFFAOYSA-NInChI: InChI=1S/C9H6F3NO/c10-9(11,12)14-7-3-1-2-6-4-5-13-8(6)7/h1-5,13H
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6-Methyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indoleCas Number: 912332-45-7 Compound CID: 53216784Formula: C15H20BNO2 Molecular Weight: 257.14IUPAC Name: 6-methyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indoleSMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(N2)C=C(C=C3)CInChIKey: DJFGVVLVJWDLJI-UHFFFAOYSA-NInChI: InChI=1S/C15H20BNO2/c1-10-6-7-11-9-13(17-12(11)8-10)16-18-14(2,3)15(4,5)19-16/h6-9,17H,1-5H3
