[2-(3,4-dimethylphenyl)-5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl] ethanoate

Systemtic Name: [2-(3,4-dimethylphenyl)-5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl] ethanoate Openeye Name: [2-(3,4-dimethylphenyl)-5,5-dimethyl-3-oxo-cyclohexen-1-yl] acetate CAS Name: acetic acid [2-(3,4-dimethylphenyl)-5,5-dimethyl-3-oxo-1-cyclohexenyl] ester IUPAC Name: [2-(3,4-dimethylphenyl)-5,5-dimethyl-3-oxocyclohexen-1-yl] acetate Traditional Name: acetic acid [2-(3,4-dimethylphenyl)-3-keto-5,5-dimethyl-cyclohexen-1-yl] ester Formula: C18H22O3 MolecularWeight: 286.36548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=C(CC(CC2=O)(C)C)OC(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=C(CC(CC2=O)(C)C)OC(=O)C)C

InChI

InChI=1S/C18H22O3/c1-11-6-7-14(8-12(11)2)17-15(20)9-18(4,5)10-16(17)21-13(3)19/h6-8H,9-10H2,1-5H3