2-butanoyl-3-methoxy-5,5-dimethyl-cyclohex-2-en-1-one

Systemtic Name: 2-butanoyl-3-methoxy-5,5-dimethyl-cyclohex-2-en-1-one Openeye Name: 2-butanoyl-3-methoxy-5,5-dimethyl-cyclohex-2-en-1-one CAS Name: 3-methoxy-5,5-dimethyl-2-(1-oxobutyl)-1-cyclohex-2-enone IUPAC Name: 2-butanoyl-3-methoxy-5,5-dimethylcyclohex-2-en-1-one Traditional Name: 2-butyryl-3-methoxy-5,5-dimethyl-cyclohex-2-en-1-one Formula: C13H20O3 MolecularWeight: 224.2961

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20O3/c1-5-6-9(14)12-10(15)7-13(2,3)8-11(12)16-4/h5-8H2,1-4H3