butyl 3,3-dimethyl-6-oxidanylidene-cyclohexene-1-carboxylate

Systemtic Name: butyl 3,3-dimethyl-6-oxidanylidene-cyclohexene-1-carboxylate Openeye Name: butyl 3,3-dimethyl-6-oxo-cyclohexene-1-carboxylate CAS Name: 3,3-dimethyl-6-oxo-1-cyclohexenecarboxylic acid butyl ester IUPAC Name: butyl 3,3-dimethyl-6-oxocyclohexene-1-carboxylate Traditional Name: 6-keto-3,3-dimethyl-cyclohexene-1-carboxylic acid butyl ester Formula: C13H20O3 MolecularWeight: 224.2961

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC(CCC1=O)(C)C

Isomeric SMILES

CCCCOC(=O)C1=CC(CCC1=O)(C)C

InChI

InChI=1S/C13H20O3/c1-4-5-8-16-12(15)10-9-13(2,3)7-6-11(10)14/h9H,4-8H2,1-3H3