2-azanyl-5-[[3-carboxy-4-[(4-phenylphenyl)carbonylamino]phenyl]methyl]benzoic acid

Systemtic Name: 2-azanyl-5-[[3-carboxy-4-[(4-phenylphenyl)carbonylamino]phenyl]methyl]benzoic acid Openeye Name: 2-amino-5-[[3-carboxy-4-[(4-phenylbenzoyl)amino]phenyl]methyl]benzoic acid CAS Name: 2-amino-5-[[3-carboxy-4-[[oxo-(4-phenylphenyl)methyl]amino]phenyl]methyl]benzoic acid IUPAC Name: 2-amino-5-[[3-carboxy-4-[(4-phenylbenzoyl)amino]phenyl]methyl]benzoic acid Traditional Name: 2-amino-5-[3-carboxy-4-[(4-phenylbenzoyl)amino]benzyl]benzoic acid Formula: C28H22N2O5 MolecularWeight: 466.48468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)NC3=C(C=C(C=C3)CC4=CC(=C(C=C4)N)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)NC3=C(C=C(C=C3)CC4=CC(=C(C=C4)N)C(=O)O)C(=O)O

InChI

InChI=1S/C28H22N2O5/c29-24-12-6-17(15-22(24)27(32)33)14-18-7-13-25(23(16-18)28(34)35)30-26(31)21-10-8-20(9-11-21)19-4-2-1-3-5-19/h1-13,15-16H,14,29H2,(H,30,31)(H,32,33)(H,34,35)