3-methoxy-4-[[6-[2-(4-phenylphenyl)ethanoylamino]indol-1-yl]methyl]benzoic acid

Systemtic Name: 3-methoxy-4-[[6-[2-(4-phenylphenyl)ethanoylamino]indol-1-yl]methyl]benzoic acid Openeye Name: 3-methoxy-4-[[6-[[2-(4-phenylphenyl)acetyl]amino]indol-1-yl]methyl]benzoic acid CAS Name: 3-methoxy-4-[[6-[[1-oxo-2-(4-phenylphenyl)ethyl]amino]-1-indolyl]methyl]benzoic acid IUPAC Name: 3-methoxy-4-[[6-[[2-(4-phenylphenyl)acetyl]amino]indol-1-yl]methyl]benzoic acid Traditional Name: 3-methoxy-4-[[6-[[2-(4-phenylphenyl)acetyl]amino]indol-1-yl]methyl]benzoic acid Formula: C31H26N2O4 MolecularWeight: 490.54914

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)O)CN2C=CC3=C2C=C(C=C3)NC(=O)CC4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)O)CN2C=CC3=C2C=C(C=C3)NC(=O)CC4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H26N2O4/c1-37-29-18-25(31(35)36)11-12-26(29)20-33-16-15-24-13-14-27(19-28(24)33)32-30(34)17-21-7-9-23(10-8-21)22-5-3-2-4-6-22/h2-16,18-19H,17,20H2,1H3,(H,32,34)(H,35,36)