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6-methyl-1-[(2-methylphenyl)methyl]-3-[(phenethylamino)methyl]indole-2-carboxylic acid
6-methyl-1-[(2-methylphenyl)methyl]-3-[(phenethylamino)methyl]indole-2-carboxylic acid
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Descriptors Computed from Structure
Canonical SMILES:
CC1=CC2=C(C=C1)C(=C(N2CC3=CC=CC=C3C)C(=O)O)CNCCC4=CC=CC=C4
Isomeric SMILES
CC1=CC2=C(C=C1)C(=C(N2CC3=CC=CC=C3C)C(=O)O)CNCCC4=CC=CC=C4
InChI
InChI=1S/C27H28N2O2/c1-19-12-13-23-24(17-28-15-14-21-9-4-3-5-10-21)26(27(30)31)29(25(23)16-19)18-22-11-7-6-8-20(22)2/h3-13,16,28H,14-15,17-18H2,1-2H3,(H,30,31)
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