(4-cyano-2,3,3-trimethyl-cyclohexen-1-yl) ethanoate

Systemtic Name: (4-cyano-2,3,3-trimethyl-cyclohexen-1-yl) ethanoate Openeye Name: (4-cyano-2,3,3-trimethyl-cyclohexen-1-yl) acetate CAS Name: acetic acid (4-cyano-2,3,3-trimethyl-1-cyclohexenyl) ester IUPAC Name: (4-cyano-2,3,3-trimethylcyclohexen-1-yl) acetate Traditional Name: acetic acid (4-cyano-2,3,3-trimethyl-cyclohexen-1-yl) ester Formula: C12H17NO2 MolecularWeight: 207.26888

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17NO2/c1-8-11(15-9(2)14)6-5-10(7-13)12(8,3)4/h10H,5-6H2,1-4H3