(3,3-dimethyl-5-methylidene-6-oxidanylidene-cyclohexen-1-yl) propanoate

Systemtic Name: (3,3-dimethyl-5-methylidene-6-oxidanylidene-cyclohexen-1-yl) propanoate Openeye Name: (3,3-dimethyl-5-methylene-6-oxo-cyclohexen-1-yl) propanoate CAS Name: propanoic acid (3,3-dimethyl-5-methylene-6-oxo-1-cyclohexenyl) ester IUPAC Name: (3,3-dimethyl-5-methylidene-6-oxocyclohexen-1-yl) propanoate Traditional Name: propionic acid (6-keto-3,3-dimethyl-5-methylene-cyclohexen-1-yl) ester Formula: C12H16O3 MolecularWeight: 208.25364

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=CC(CC(=C)C1=O)(C)C

Isomeric SMILES

CCC(=O)OC1=CC(CC(=C)C1=O)(C)C

InChI

InChI=1S/C12H16O3/c1-5-10(13)15-9-7-12(3,4)6-8(2)11(9)14/h7H,2,5-6H2,1,3-4H3