4-oxidanylidene-4-[[3-(3-phenylpropanoylamino)phenyl]amino]butanoic acid

Systemtic Name: 4-oxidanylidene-4-[[3-(3-phenylpropanoylamino)phenyl]amino]butanoic acid Openeye Name: 4-oxo-4-[3-(3-phenylpropanoylamino)anilino]butanoic acid CAS Name: 4-oxo-4-[3-[(1-oxo-3-phenylpropyl)amino]anilino]butanoic acid IUPAC Name: 4-oxo-4-[3-(3-phenylpropanoylamino)anilino]butanoic acid Traditional Name: 4-[3-(hydrocinnamoylamino)anilino]-4-keto-butyric acid Formula: C19H20N2O4 MolecularWeight: 340.3731

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2O4/c22-17(10-9-14-5-2-1-3-6-14)20-15-7-4-8-16(13-15)21-18(23)11-12-19(24)25/h1-8,13H,9-12H2,(H,20,22)(H,21,23)(H,24,25)