5-(4-chlorophenyl)-2-cyano-5-oxidanylidene-3-phenyl-pentanoic acid

Systemtic Name: 5-(4-chlorophenyl)-2-cyano-5-oxidanylidene-3-phenyl-pentanoic acid Openeye Name: 5-(4-chlorophenyl)-2-cyano-5-oxo-3-phenyl-pentanoic acid CAS Name: 5-(4-chlorophenyl)-2-cyano-5-oxo-3-phenylpentanoic acid IUPAC Name: 5-(4-chlorophenyl)-2-cyano-5-oxo-3-phenylpentanoic acid Traditional Name: 5-(4-chlorophenyl)-2-cyano-5-keto-3-phenyl-valeric acid Formula: C18H14ClNO3 MolecularWeight: 327.76166

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)C2=CC=C(C=C2)Cl)C(C#N)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(CC(=O)C2=CC=C(C=C2)Cl)C(C#N)C(=O)O

InChI

InChI=1S/C18H14ClNO3/c19-14-8-6-13(7-9-14)17(21)10-15(16(11-20)18(22)23)12-4-2-1-3-5-12/h1-9,15-16H,10H2,(H,22,23)