3-(diphenylmethyl)-4-[2-[methyl(phenylmethoxycarbonyl)amino]ethyl]-1H-indole-2-carboxylic acid

Systemtic Name: 3-(diphenylmethyl)-4-[2-[methyl(phenylmethoxycarbonyl)amino]ethyl]-1H-indole-2-carboxylic acid Openeye Name: 3-benzhydryl-4-[2-[benzyloxycarbonyl(methyl)amino]ethyl]-1H-indole-2-carboxylic acid CAS Name: 3-(diphenylmethyl)-4-[2-[methyl(phenylmethoxycarbonyl)amino]ethyl]-1H-indole-2-carboxylic acid IUPAC Name: 3-benzhydryl-4-[2-[methyl(phenylmethoxycarbonyl)amino]ethyl]-1H-indole-2-carboxylic acid Traditional Name: 3-benzhydryl-4-[2-[carbobenzoxy(methyl)amino]ethyl]-1H-indole-2-carboxylic acid Formula: C33H30N2O4 MolecularWeight: 518.6023

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=C2C(=CC=C1)NC(=C2C(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)O)C(=O)OCC5=CC=CC=C5

Isomeric SMILES

CN(CCC1=C2C(=CC=C1)NC(=C2C(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)O)C(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C33H30N2O4/c1-35(33(38)39-22-23-12-5-2-6-13-23)21-20-26-18-11-19-27-29(26)30(31(34-27)32(36)37)28(24-14-7-3-8-15-24)25-16-9-4-10-17-25/h2-19,28,34H,20-22H2,1H3,(H,36,37)