[4-cyano-2-(2-methyl-1-oxidanylidene-propan-2-yl)phenyl] butanoate

Systemtic Name: [4-cyano-2-(2-methyl-1-oxidanylidene-propan-2-yl)phenyl] butanoate Openeye Name: [4-cyano-2-(1,1-dimethyl-2-oxo-ethyl)phenyl] butanoate CAS Name: butanoic acid [4-cyano-2-(2-methyl-1-oxopropan-2-yl)phenyl] ester IUPAC Name: [4-cyano-2-(2-methyl-1-oxopropan-2-yl)phenyl] butanoate Traditional Name: butyric acid [4-cyano-2-(2-keto-1,1-dimethyl-ethyl)phenyl] ester Formula: C15H17NO3 MolecularWeight: 259.30038

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=C(C=C(C=C1)C#N)C(C)(C)C=O

Isomeric SMILES

CCCC(=O)OC1=C(C=C(C=C1)C#N)C(C)(C)C=O

InChI

InChI=1S/C15H17NO3/c1-4-5-14(18)19-13-7-6-11(9-16)8-12(13)15(2,3)10-17/h6-8,10H,4-5H2,1-3H3