(2,2-dimethyl-5-oxidanylidene-cyclohex-3-en-1-yl) butanoate

Systemtic Name: (2,2-dimethyl-5-oxidanylidene-cyclohex-3-en-1-yl) butanoate Openeye Name: (2,2-dimethyl-5-oxo-cyclohex-3-en-1-yl) butanoate CAS Name: butanoic acid (2,2-dimethyl-5-oxo-1-cyclohex-3-enyl) ester IUPAC Name: (2,2-dimethyl-5-oxocyclohex-3-en-1-yl) butanoate Traditional Name: butyric acid (5-keto-2,2-dimethyl-cyclohex-3-en-1-yl) ester Formula: C12H18O3 MolecularWeight: 210.26952

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1CC(=O)C=CC1(C)C

Isomeric SMILES

CCCC(=O)OC1CC(=O)C=CC1(C)C

InChI

InChI=1S/C12H18O3/c1-4-5-11(14)15-10-8-9(13)6-7-12(10,2)3/h6-7,10H,4-5,8H2,1-3H3