3,4-bis(3-phenylpropanoylamino)benzoic acid

Systemtic Name: 3,4-bis(3-phenylpropanoylamino)benzoic acid Openeye Name: 3,4-bis(3-phenylpropanoylamino)benzoic acid CAS Name: 3,4-bis[(1-oxo-3-phenylpropyl)amino]benzoic acid IUPAC Name: 3,4-bis(3-phenylpropanoylamino)benzoic acid Traditional Name: 3,4-bis(hydrocinnamoylamino)benzoic acid Formula: C25H24N2O4 MolecularWeight: 416.46906

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(=O)NC2=C(C=C(C=C2)C(=O)O)NC(=O)CCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CCC(=O)NC2=C(C=C(C=C2)C(=O)O)NC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C25H24N2O4/c28-23(15-11-18-7-3-1-4-8-18)26-21-14-13-20(25(30)31)17-22(21)27-24(29)16-12-19-9-5-2-6-10-19/h1-10,13-14,17H,11-12,15-16H2,(H,26,28)(H,27,29)(H,30,31)