3,5,5-trimethyl-4-(3-oxidanylidenebutyl)cyclohex-2-en-1-one

Systemtic Name: 3,5,5-trimethyl-4-(3-oxidanylidenebutyl)cyclohex-2-en-1-one Openeye Name: 3,5,5-trimethyl-4-(3-oxobutyl)cyclohex-2-en-1-one CAS Name: 3,5,5-trimethyl-4-(3-oxobutyl)-1-cyclohex-2-enone IUPAC Name: 3,5,5-trimethyl-4-(3-oxobutyl)cyclohex-2-en-1-one Traditional Name: 4-(3-ketobutyl)-3,5,5-trimethyl-cyclohex-2-en-1-one Formula: C13H20O2 MolecularWeight: 208.2967

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)CC(C1CCC(=O)C)(C)C

Isomeric SMILES

CC1=CC(=O)CC(C1CCC(=O)C)(C)C

InChI

InChI=1S/C13H20O2/c1-9-7-11(15)8-13(3,4)12(9)6-5-10(2)14/h7,12H,5-6,8H2,1-4H3