4-[(Z)-2-cyano-1-(2-oxidanylideneethylamino)ethenyl]-2-methyl-benzoic acid

Systemtic Name: 4-[(Z)-2-cyano-1-(2-oxidanylideneethylamino)ethenyl]-2-methyl-benzoic acid Openeye Name: 4-[(Z)-2-cyano-1-(2-oxoethylamino)vinyl]-2-methyl-benzoic acid CAS Name: 4-[(Z)-2-cyano-1-(2-oxoethylamino)ethenyl]-2-methylbenzoic acid IUPAC Name: 4-[(Z)-2-cyano-1-(2-oxoethylamino)ethenyl]-2-methylbenzoic acid Traditional Name: 4-[(Z)-2-cyano-1-(2-ketoethylamino)vinyl]-2-methyl-benzoic acid Formula: C13H12N2O3 MolecularWeight: 244.24598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=CC#N)NCC=O)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)/C(=C/C#N)/NCC=O)C(=O)O

InChI

InChI=1S/C13H12N2O3/c1-9-8-10(2-3-11(9)13(17)18)12(4-5-14)15-6-7-16/h2-4,7-8,15H,6H2,1H3,(H,17,18)/b12-4-