2,4,4-trimethyl-3-(3-oxidanylidenebutyl)cyclohexan-1-one

Systemtic Name: 2,4,4-trimethyl-3-(3-oxidanylidenebutyl)cyclohexan-1-one Openeye Name: 2,4,4-trimethyl-3-(3-oxobutyl)cyclohexanone CAS Name: 2,4,4-trimethyl-3-(3-oxobutyl)-1-cyclohexanone IUPAC Name: 2,4,4-trimethyl-3-(3-oxobutyl)cyclohexan-1-one Traditional Name: 3-(3-ketobutyl)-2,4,4-trimethyl-cyclohexanone Formula: C13H22O2 MolecularWeight: 210.31258

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(CCC1=O)(C)C)CCC(=O)C

Isomeric SMILES

CC1C(C(CCC1=O)(C)C)CCC(=O)C

InChI

InChI=1S/C13H22O2/c1-9(14)5-6-11-10(2)12(15)7-8-13(11,3)4/h10-11H,5-8H2,1-4H3