[2,4,4-trimethyl-3-[(E)-3-oxidanylidenebut-1-enyl]cyclohex-2-en-1-yl] ethanoate

Systemtic Name: [2,4,4-trimethyl-3-[(E)-3-oxidanylidenebut-1-enyl]cyclohex-2-en-1-yl] ethanoate Openeye Name: [2,4,4-trimethyl-3-[(E)-3-oxobut-1-enyl]cyclohex-2-en-1-yl] acetate CAS Name: acetic acid [2,4,4-trimethyl-3-[(E)-3-oxobut-1-enyl]-1-cyclohex-2-enyl] ester IUPAC Name: [2,4,4-trimethyl-3-[(E)-3-oxobut-1-enyl]cyclohex-2-en-1-yl] acetate Traditional Name: acetic acid [3-[(E)-3-ketobut-1-enyl]-2,4,4-trimethyl-cyclohex-2-en-1-yl] ester Formula: C15H22O3 MolecularWeight: 250.33338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CCC1OC(=O)C)(C)C)C=CC(=O)C

Isomeric SMILES

CC1=C(C(CCC1OC(=O)C)(C)C)/C=C/C(=O)C

InChI

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