4-[3-[[(4-methoxyphenyl)carbonyl-(phenylmethyl)amino]methyl]phenyl]benzoic acid

Systemtic Name: 4-[3-[[(4-methoxyphenyl)carbonyl-(phenylmethyl)amino]methyl]phenyl]benzoic acid Openeye Name: 4-[3-[[benzyl-(4-methoxybenzoyl)amino]methyl]phenyl]benzoic acid CAS Name: 4-[3-[[[(4-methoxyphenyl)-oxomethyl]-(phenylmethyl)amino]methyl]phenyl]benzoic acid IUPAC Name: 4-[3-[[benzyl-(4-methoxybenzoyl)amino]methyl]phenyl]benzoic acid Traditional Name: 4-[3-[[benzyl(p-anisoyl)amino]methyl]phenyl]benzoic acid Formula: C29H25NO4 MolecularWeight: 451.5131

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N(CC2=CC=CC=C2)CC3=CC=CC(=C3)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N(CC2=CC=CC=C2)CC3=CC=CC(=C3)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C29H25NO4/c1-34-27-16-14-24(15-17-27)28(31)30(19-21-6-3-2-4-7-21)20-22-8-5-9-26(18-22)23-10-12-25(13-11-23)29(32)33/h2-18H,19-20H2,1H3,(H,32,33)