[(E)-4-(2,6,6-trimethyl-3-oxidanylidene-cyclohexen-1-yl)but-3-en-2-yl] ethanoate

Systemtic Name: [(E)-4-(2,6,6-trimethyl-3-oxidanylidene-cyclohexen-1-yl)but-3-en-2-yl] ethanoate Openeye Name: [(E)-1-methyl-3-(2,6,6-trimethyl-3-oxo-cyclohexen-1-yl)allyl] acetate CAS Name: acetic acid [(E)-4-(2,6,6-trimethyl-3-oxo-1-cyclohexenyl)but-3-en-2-yl] ester IUPAC Name: [(E)-4-(2,6,6-trimethyl-3-oxocyclohexen-1-yl)but-3-en-2-yl] acetate Traditional Name: acetic acid [(E)-3-(3-keto-2,6,6-trimethyl-cyclohexen-1-yl)-1-methyl-allyl] ester Formula: C15H22O3 MolecularWeight: 250.33338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CCC1=O)(C)C)C=CC(C)OC(=O)C

Isomeric SMILES

CC1=C(C(CCC1=O)(C)C)/C=C/C(C)OC(=O)C

InChI

InChI=1S/C15H22O3/c1-10(18-12(3)16)6-7-13-11(2)14(17)8-9-15(13,4)5/h6-7,10H,8-9H2,1-5H3/b7-6+