4-butyl-3,3,5-trimethyl-cyclohexan-1-one

Systemtic Name: 4-butyl-3,3,5-trimethyl-cyclohexan-1-one Openeye Name: 4-butyl-3,3,5-trimethyl-cyclohexanone CAS Name: 4-butyl-3,3,5-trimethyl-1-cyclohexanone IUPAC Name: 4-butyl-3,3,5-trimethylcyclohexan-1-one Traditional Name: 4-butyl-3,3,5-trimethyl-cyclohexanone Formula: C13H24O MolecularWeight: 196.32906

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(CC(=O)CC1(C)C)C

Isomeric SMILES

CCCCC1C(CC(=O)CC1(C)C)C

InChI

InChI=1S/C13H24O/c1-5-6-7-12-10(2)8-11(14)9-13(12,3)4/h10,12H,5-9H2,1-4H3