3-phenyl-1-[(4-phenylazanylphenyl)methyl]indole-2-carboxylic acid

Systemtic Name: 3-phenyl-1-[(4-phenylazanylphenyl)methyl]indole-2-carboxylic acid Openeye Name: 1-[(4-anilinophenyl)methyl]-3-phenyl-indole-2-carboxylic acid CAS Name: 1-[(4-anilinophenyl)methyl]-3-phenyl-2-indolecarboxylic acid IUPAC Name: 1-[(4-anilinophenyl)methyl]-3-phenylindole-2-carboxylic acid Traditional Name: 1-(4-anilinobenzyl)-3-phenyl-indole-2-carboxylic acid Formula: C28H22N2O2 MolecularWeight: 418.48648

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N(C3=CC=CC=C32)CC4=CC=C(C=C4)NC5=CC=CC=C5)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N(C3=CC=CC=C32)CC4=CC=C(C=C4)NC5=CC=CC=C5)C(=O)O

InChI

InChI=1S/C28H22N2O2/c31-28(32)27-26(21-9-3-1-4-10-21)24-13-7-8-14-25(24)30(27)19-20-15-17-23(18-16-20)29-22-11-5-2-6-12-22/h1-18,29H,19H2,(H,31,32)