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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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2，2，2-trifluoro-1-(1H-indol-5-yl)ethanoneCas Number: 170366-90-2 Compound CID: 45081109Formula: C10H6F3NO Molecular Weight: 213.16IUPAC Name: 2,2,2-trifluoro-1-(1H-indol-5-yl)ethanoneSMILES: C1=CC2=C(C=CN2)C=C1C(=O)C(F)(F)FInChIKey: BEAXZGXRMVALGL-UHFFFAOYSA-NInChI: InChI=1S/C10H6F3NO/c11-10(12,13)9(15)7-1-2-8-6(5-7)3-4-14-8/h1-5,14H -
2-Phenylindole-3-AcetonitrileCas Number: 27005-52-3 Compound CID: 7021099Formula: C16H12N2 Molecular Weight: 232.28IUPAC Name: 2-(2-phenyl-1H-indol-3-yl)acetonitrileSMILES: C1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2)CC#NInChIKey: CNAHOBNLHXZPRN-UHFFFAOYSA-NInChI: InChI=1S/C16H12N2/c17-11-10-14-13-8-4-5-9-15(13)18-16(14)12-6-2-1-3-7-12/h1-9,18H,10H2
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2-Phenyl-3-(piperidin-4-yl)-1H-indoleCas Number: 221109-26-8 Compound CID: 9882067Formula: C19H20N2 Molecular Weight: 276.38IUPAC Name: 2-phenyl-3-piperidin-4-yl-1H-indoleSMILES: C1CNCCC1C2=C(NC3=CC=CC=C32)C4=CC=CC=C4InChIKey: FWPAVENSJPMGJO-UHFFFAOYSA-NInChI: InChI=1S/C19H20N2/c1-2-6-15(7-3-1)19-18(14-10-12-20-13-11-14)16-8-4-5-9-17(16)21-19/h1-9,14,20-21H,10-13H2
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2-Isopropyl-1H-indoleCas Number: 17790-93-1 Compound CID: 87307Formula: C11H13N Molecular Weight: 159.23IUPAC Name: 2-propan-2-yl-1H-indoleSMILES: CC(C)C1=CC2=CC=CC=C2N1InChIKey: XSRLHGSAMGVDJU-UHFFFAOYSA-NInChI: InChI=1S/C11H13N/c1-8(2)11-7-9-5-3-4-6-10(9)12-11/h3-8,12H,1-2H3
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2-Ethoxy-1H-indoleCas Number: 1009-27-4 Compound CID: 12287052Formula: C10H11NO Molecular Weight: 161.2IUPAC Name: 2-ethoxy-1H-indoleSMILES: CCOC1=CC2=CC=CC=C2N1InChIKey: LKEJIEFLJHCIAK-UHFFFAOYSA-NInChI: InChI=1S/C10H11NO/c1-2-12-10-7-8-5-3-4-6-9(8)11-10/h3-7,11H,2H2,1H3
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2-Bromo-1H-indoleCas Number: 139409-34-0 Compound CID: 11805631Formula: C8H6BrN Molecular Weight: 196.04IUPAC Name: 2-bromo-1H-indoleSMILES: C1=CC=C2C(=C1)C=C(N2)BrInChIKey: ZPRQXVPYQGBZON-UHFFFAOYSA-NInChI: InChI=1S/C8H6BrN/c9-8-5-6-3-1-2-4-7(6)10-8/h1-5,10H
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2-(6-Bromo-1H-Indol-3-Yl)AcetonitrileCas Number: 152213-61-1 Compound CID: 15819328Formula: C10H7BrN2 Molecular Weight: 235.08IUPAC Name: 2-(6-bromo-1H-indol-3-yl)acetonitrileSMILES: C1=CC2=C(C=C1Br)NC=C2CC#NInChIKey: MSIDSSLYDVKLRA-UHFFFAOYSA-NInChI: InChI=1S/C10H7BrN2/c11-8-1-2-9-7(3-4-12)6-13-10(9)5-8/h1-2,5-6,13H,3H2
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2-(6-Bromo-1H-indol-3-yl)ethanolCas Number: 214915-72-7 Compound CID: 18942297Formula: C10H10BrNO Molecular Weight: 240.1IUPAC Name: 2-(6-bromo-1H-indol-3-yl)ethanolSMILES: C1=CC2=C(C=C1Br)NC=C2CCOInChIKey: ANIPJGAEJCDVFF-UHFFFAOYSA-NInChI: InChI=1S/C10H10BrNO/c11-8-1-2-9-7(3-4-13)6-12-10(9)5-8/h1-2,5-6,12-13H,3-4H2
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2-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole-4-carbonitrileCas Number: 1256359-19-9 Compound CID: 53217127Formula: C15H17BN2O2 Molecular Weight: 268.13IUPAC Name: 2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole-4-carbonitrileSMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=CC=C3N2)C#NInChIKey: NQJHPYXWEQOLBO-UHFFFAOYSA-NInChI: InChI=1S/C15H17BN2O2/c1-14(2)15(3,4)20-16(19-14)13-8-11-10(9-17)6-5-7-12(11)18-13/h5-8,18H,1-4H3
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4-Benzyloxyindole-3-acetonitrileCas Number: 1464-11-5 EC Number: 861-301-8Formula: C17H14N2O Molecular Weight: 262.31IUPAC Name: 2-(4-phenylmethoxy-1H-indol-3-yl)acetonitrileSMILES: C1=CC=C(C=C1)COC2=CC=CC3=C2C(=CN3)CC#NInChIKey: OCROQGOQZBRSBQ-UHFFFAOYSA-NInChI: InChI=1S/C17H14N2O/c18-10-9-14-11-19-15-7-4-8-16(17(14)15)20-12-13-5-2-1-3-6-13/h1-8,11,19H,9,12H2Synonyms: 2-[4-(benzyloxy)-1h-indol-3-yl]acetonitrile | 4-Benzyloxyindole-3-acetonitrile
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2-(1H-Indol-3-yl)-2-methylpropanenitrileCas Number: 23078-29-7 Compound CID: 23113643Formula: C12H12N2 Molecular Weight: 184.24IUPAC Name: 2-(1H-indol-3-yl)-2-methylpropanenitrileSMILES: CC(C)(C#N)C1=CNC2=CC=CC=C21InChIKey: CIPHSCQFFHSUGX-UHFFFAOYSA-NInChI: InChI=1S/C12H12N2/c1-12(2,8-13)10-7-14-11-6-4-3-5-9(10)11/h3-7,14H,1-2H3
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2-(1H-Indol-5-yl)acetonitrileCas Number: 23690-49-5 Compound CID: 15290857Formula: C10H8N2 Molecular Weight: 156.18IUPAC Name: 2-(1H-indol-5-yl)acetonitrileSMILES: C1=CC2=C(C=CN2)C=C1CC#NInChIKey: OXUQBDQMQTZQPK-UHFFFAOYSA-NInChI: InChI=1S/C10H8N2/c11-5-3-8-1-2-10-9(7-8)4-6-12-10/h1-2,4,6-7,12H,3H2
