2-[[(E)-1-azanyl-1-oxidanylidene-3-phenyl-but-2-en-2-yl]amino]benzoic acid

Systemtic Name: 2-[[(E)-1-azanyl-1-oxidanylidene-3-phenyl-but-2-en-2-yl]amino]benzoic acid Openeye Name: 2-[[(E)-1-carbamoyl-2-phenyl-prop-1-enyl]amino]benzoic acid CAS Name: 2-[[(E)-1-amino-1-oxo-3-phenylbut-2-en-2-yl]amino]benzoic acid IUPAC Name: 2-[[(E)-1-amino-1-oxo-3-phenylbut-2-en-2-yl]amino]benzoic acid Traditional Name: 2-[[(E)-1-carbamoyl-2-phenyl-prop-1-enyl]amino]benzoic acid Formula: C17H16N2O3 MolecularWeight: 296.32054

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C(=O)N)NC1=CC=CC=C1C(=O)O)C2=CC=CC=C2

Isomeric SMILES

C/C(=C(/C(=O)N)\NC1=CC=CC=C1C(=O)O)/C2=CC=CC=C2

InChI

InChI=1S/C17H16N2O3/c1-11(12-7-3-2-4-8-12)15(16(18)20)19-14-10-6-5-9-13(14)17(21)22/h2-10,19H,1H3,(H2,18,20)(H,21,22)/b15-11+