ethyl 6-cyano-6-(2,4-dimethylphenyl)-5-oxidanylidene-hexanoate

Systemtic Name: ethyl 6-cyano-6-(2,4-dimethylphenyl)-5-oxidanylidene-hexanoate Openeye Name: ethyl 6-cyano-6-(2,4-dimethylphenyl)-5-oxo-hexanoate CAS Name: 6-cyano-6-(2,4-dimethylphenyl)-5-oxohexanoic acid ethyl ester IUPAC Name: ethyl 6-cyano-6-(2,4-dimethylphenyl)-5-oxohexanoate Traditional Name: 6-cyano-6-(2,4-dimethylphenyl)-5-keto-hexanoic acid ethyl ester Formula: C17H21NO3 MolecularWeight: 287.35354

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCC(=O)C(C#N)C1=C(C=C(C=C1)C)C

Isomeric SMILES

CCOC(=O)CCCC(=O)C(C#N)C1=C(C=C(C=C1)C)C

InChI

InChI=1S/C17H21NO3/c1-4-21-17(20)7-5-6-16(19)15(11-18)14-9-8-12(2)10-13(14)3/h8-10,15H,4-7H2,1-3H3