(E)-4-oxidanylidene-4-[[3-[(phenylmethyl)carbamoyl]phenyl]amino]but-2-enoic acid

Systemtic Name: (E)-4-oxidanylidene-4-[[3-[(phenylmethyl)carbamoyl]phenyl]amino]but-2-enoic acid Openeye Name: (E)-4-[3-(benzylcarbamoyl)anilino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-oxo-4-[3-[oxo-[(phenylmethyl)amino]methyl]anilino]-2-butenoic acid IUPAC Name: (E)-4-[3-(benzylcarbamoyl)anilino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[3-(benzylcarbamoyl)anilino]-4-keto-but-2-enoic acid Formula: C18H16N2O4 MolecularWeight: 324.33064

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C2=CC(=CC=C2)NC(=O)C=CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C2=CC(=CC=C2)NC(=O)/C=C/C(=O)O

InChI

InChI=1S/C18H16N2O4/c21-16(9-10-17(22)23)20-15-8-4-7-14(11-15)18(24)19-12-13-5-2-1-3-6-13/h1-11H,12H2,(H,19,24)(H,20,21)(H,22,23)/b10-9+