methyl 3-(4,4-dimethyl-2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)propanoate

Systemtic Name: methyl 3-(4,4-dimethyl-2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)propanoate Openeye Name: methyl 3-(2-hydroxy-4,4-dimethyl-6-oxo-cyclohexen-1-yl)propanoate CAS Name: 3-(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexenyl)propanoic acid methyl ester IUPAC Name: methyl 3-(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)propanoate Traditional Name: 3-(2-hydroxy-6-keto-4,4-dimethyl-cyclohexen-1-yl)propionic acid methyl ester Formula: C12H18O4 MolecularWeight: 226.26892

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C(C(=O)C1)CCC(=O)OC)O)C

Isomeric SMILES

CC1(CC(=C(C(=O)C1)CCC(=O)OC)O)C

InChI

InChI=1S/C12H18O4/c1-12(2)6-9(13)8(10(14)7-12)4-5-11(15)16-3/h13H,4-7H2,1-3H3