[3-[(E)-1-cyano-3-methoxy-prop-2-enyl]-3-methyl-cyclohexen-1-yl] ethanoate

Systemtic Name: [3-[(E)-1-cyano-3-methoxy-prop-2-enyl]-3-methyl-cyclohexen-1-yl] ethanoate Openeye Name: [3-[(E)-1-cyano-3-methoxy-allyl]-3-methyl-cyclohexen-1-yl] acetate CAS Name: acetic acid [3-[(E)-1-cyano-3-methoxyprop-2-enyl]-3-methyl-1-cyclohexenyl] ester IUPAC Name: [3-[(E)-1-cyano-3-methoxyprop-2-enyl]-3-methylcyclohexen-1-yl] acetate Traditional Name: acetic acid [3-[(E)-1-cyano-3-methoxy-allyl]-3-methyl-cyclohexen-1-yl] ester Formula: C14H19NO3 MolecularWeight: 249.30556

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC(CCC1)(C)C(C=COC)C#N

Isomeric SMILES

CC(=O)OC1=CC(CCC1)(C)C(/C=C/OC)C#N

InChI

InChI=1S/C14H19NO3/c1-11(16)18-13-5-4-7-14(2,9-13)12(10-15)6-8-17-3/h6,8-9,12H,4-5,7H2,1-3H3/b8-6+