methyl 4,4-dicyano-6-(4-methylphenyl)-6-oxidanylidene-hexanoate

Systemtic Name: methyl 4,4-dicyano-6-(4-methylphenyl)-6-oxidanylidene-hexanoate Openeye Name: methyl 4,4-dicyano-6-oxo-6-(p-tolyl)hexanoate CAS Name: 4,4-dicyano-6-(4-methylphenyl)-6-oxohexanoic acid methyl ester IUPAC Name: methyl 4,4-dicyano-6-(4-methylphenyl)-6-oxohexanoate Traditional Name: 4,4-dicyano-6-keto-6-(p-tolyl)hexanoic acid methyl ester Formula: C16H16N2O3 MolecularWeight: 284.30984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CC(CCC(=O)OC)(C#N)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CC(CCC(=O)OC)(C#N)C#N

InChI

InChI=1S/C16H16N2O3/c1-12-3-5-13(6-4-12)14(19)9-16(10-17,11-18)8-7-15(20)21-2/h3-6H,7-9H2,1-2H3