3-[[4-(phenylmethoxycarbonylaminomethyl)phenyl]carbonylamino]benzoic acid

Systemtic Name: 3-[[4-(phenylmethoxycarbonylaminomethyl)phenyl]carbonylamino]benzoic acid Openeye Name: 3-[[4-(benzyloxycarbonylaminomethyl)benzoyl]amino]benzoic acid CAS Name: 3-[[oxo-[4-(phenylmethoxycarbonylaminomethyl)phenyl]methyl]amino]benzoic acid IUPAC Name: 3-[[4-(phenylmethoxycarbonylaminomethyl)benzoyl]amino]benzoic acid Traditional Name: 3-[[4-(benzyloxycarbonylaminomethyl)benzoyl]amino]benzoic acid Formula: C23H20N2O5 MolecularWeight: 404.4153

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NCC2=CC=C(C=C2)C(=O)NC3=CC=CC(=C3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NCC2=CC=C(C=C2)C(=O)NC3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C23H20N2O5/c26-21(25-20-8-4-7-19(13-20)22(27)28)18-11-9-16(10-12-18)14-24-23(29)30-15-17-5-2-1-3-6-17/h1-13H,14-15H2,(H,24,29)(H,25,26)(H,27,28)