3-(4-chlorophenyl)-3-cyano-2-oxidanylidene-butanoic acid

Systemtic Name: 3-(4-chlorophenyl)-3-cyano-2-oxidanylidene-butanoic acid Openeye Name: 3-(4-chlorophenyl)-3-cyano-2-oxo-butanoic acid CAS Name: 3-(4-chlorophenyl)-3-cyano-2-oxobutanoic acid IUPAC Name: 3-(4-chlorophenyl)-3-cyano-2-oxobutanoic acid Traditional Name: 3-(4-chlorophenyl)-3-cyano-2-keto-butyric acid Formula: C11H8ClNO3 MolecularWeight: 237.63912

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H8ClNO3/c1-11(6-13,9(14)10(15)16)7-2-4-8(12)5-3-7/h2-5H,1H3,(H,15,16)