methyl 6-(3-chlorophenyl)-6-cyano-5-oxidanylidene-hexanoate

Systemtic Name: methyl 6-(3-chlorophenyl)-6-cyano-5-oxidanylidene-hexanoate Openeye Name: methyl 6-(3-chlorophenyl)-6-cyano-5-oxo-hexanoate CAS Name: 6-(3-chlorophenyl)-6-cyano-5-oxohexanoic acid methyl ester IUPAC Name: methyl 6-(3-chlorophenyl)-6-cyano-5-oxohexanoate Traditional Name: 6-(3-chlorophenyl)-6-cyano-5-keto-hexanoic acid methyl ester Formula: C14H14ClNO3 MolecularWeight: 279.71886

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14ClNO3/c1-19-14(18)7-3-6-13(17)12(9-16)10-4-2-5-11(15)8-10/h2,4-5,8,12H,3,6-7H2,1H3