5-[(3-methylphenyl)amino]-3-phenyl-1-(phenylmethyl)indole-2-carboxylic acid

Systemtic Name: 5-[(3-methylphenyl)amino]-3-phenyl-1-(phenylmethyl)indole-2-carboxylic acid Openeye Name: 1-benzyl-5-(3-methylanilino)-3-phenyl-indole-2-carboxylic acid CAS Name: 5-(3-methylanilino)-3-phenyl-1-(phenylmethyl)-2-indolecarboxylic acid IUPAC Name: 1-benzyl-5-(3-methylanilino)-3-phenylindole-2-carboxylic acid Traditional Name: 1-benzyl-5-(m-toluidino)-3-phenyl-indole-2-carboxylic acid Formula: C29H24N2O2 MolecularWeight: 432.51306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=CC3=C(C=C2)N(C(=C3C4=CC=CC=C4)C(=O)O)CC5=CC=CC=C5

Isomeric SMILES

CC1=CC(=CC=C1)NC2=CC3=C(C=C2)N(C(=C3C4=CC=CC=C4)C(=O)O)CC5=CC=CC=C5

InChI

InChI=1S/C29H24N2O2/c1-20-9-8-14-23(17-20)30-24-15-16-26-25(18-24)27(22-12-6-3-7-13-22)28(29(32)33)31(26)19-21-10-4-2-5-11-21/h2-18,30H,19H2,1H3,(H,32,33)