3-[[3-(3-phenylpropanoylamino)phenyl]carbonylamino]benzoic acid

Systemtic Name: 3-[[3-(3-phenylpropanoylamino)phenyl]carbonylamino]benzoic acid Openeye Name: 3-[[3-(3-phenylpropanoylamino)benzoyl]amino]benzoic acid CAS Name: 3-[[oxo-[3-[(1-oxo-3-phenylpropyl)amino]phenyl]methyl]amino]benzoic acid IUPAC Name: 3-[[3-(3-phenylpropanoylamino)benzoyl]amino]benzoic acid Traditional Name: 3-[[3-(hydrocinnamoylamino)benzoyl]amino]benzoic acid Formula: C23H20N2O4 MolecularWeight: 388.4159

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(=O)NC2=CC=CC(=C2)C(=O)NC3=CC=CC(=C3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCC(=O)NC2=CC=CC(=C2)C(=O)NC3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C23H20N2O4/c26-21(13-12-16-6-2-1-3-7-16)24-19-10-4-8-17(14-19)22(27)25-20-11-5-9-18(15-20)23(28)29/h1-11,14-15H,12-13H2,(H,24,26)(H,25,27)(H,28,29)