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

Systemtic Name: 5-[[3-carboxy-4-(phenylmethoxycarbonylamino)phenyl]methyl]-2-[(4-phenylphenyl)carbonylamino]benzoic acid Openeye Name: 5-[[4-(benzyloxycarbonylamino)-3-carboxy-phenyl]methyl]-2-[(4-phenylbenzoyl)amino]benzoic acid CAS Name: 5-[[3-carboxy-4-(phenylmethoxycarbonylamino)phenyl]methyl]-2-[[oxo-(4-phenylphenyl)methyl]amino]benzoic acid IUPAC Name: 5-[[3-carboxy-4-(phenylmethoxycarbonylamino)phenyl]methyl]-2-[(4-phenylbenzoyl)amino]benzoic acid Traditional Name: 5-[4-(benzyloxycarbonylamino)-3-carboxy-benzyl]-2-[(4-phenylbenzoyl)amino]benzoic acid Formula: C36H28N2O7 MolecularWeight: 600.61672

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC2=C(C=C(C=C2)CC3=CC(=C(C=C3)NC(=O)C4=CC=C(C=C4)C5=CC=CC=C5)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC2=C(C=C(C=C2)CC3=CC(=C(C=C3)NC(=O)C4=CC=C(C=C4)C5=CC=CC=C5)C(=O)O)C(=O)O

InChI

InChI=1S/C36H28N2O7/c39-33(28-15-13-27(14-16-28)26-9-5-2-6-10-26)37-31-17-11-24(20-29(31)34(40)41)19-25-12-18-32(30(21-25)35(42)43)38-36(44)45-22-23-7-3-1-4-8-23/h1-18,20-21H,19,22H2,(H,37,39)(H,38,44)(H,40,41)(H,42,43)