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

Systemtic Name: 4-[(4-chloranyl-3-cyano-phenyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-(4-chloro-3-cyano-anilino)-4-oxo-butanoic acid CAS Name: 4-(4-chloro-3-cyanoanilino)-4-oxobutanoic acid IUPAC Name: 4-(4-chloro-3-cyanoanilino)-4-oxobutanoic acid Traditional Name: 4-(4-chloro-3-cyano-anilino)-4-keto-butyric acid Formula: C11H9ClN2O3 MolecularWeight: 252.65376

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=O)CCC(=O)O)C#N)Cl

Isomeric SMILES

C1=CC(=C(C=C1NC(=O)CCC(=O)O)C#N)Cl

InChI

InChI=1S/C11H9ClN2O3/c12-9-2-1-8(5-7(9)6-13)14-10(15)3-4-11(16)17/h1-2,5H,3-4H2,(H,14,15)(H,16,17)