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

Systemtic Name: 2,4,4-trimethyl-3-(3-oxidanylbutyl)cyclohex-2-en-1-one Openeye Name: 3-(3-hydroxybutyl)-2,4,4-trimethyl-cyclohex-2-en-1-one CAS Name: 3-(3-hydroxybutyl)-2,4,4-trimethyl-1-cyclohex-2-enone IUPAC Name: 3-(3-hydroxybutyl)-2,4,4-trimethylcyclohex-2-en-1-one Traditional Name: 3-(3-hydroxybutyl)-2,4,4-trimethyl-cyclohex-2-en-1-one Formula: C13H22O2 MolecularWeight: 210.31258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CCC1=O)(C)C)CCC(C)O

Isomeric SMILES

CC1=C(C(CCC1=O)(C)C)CCC(C)O

InChI

InChI=1S/C13H22O2/c1-9(14)5-6-11-10(2)12(15)7-8-13(11,3)4/h9,14H,5-8H2,1-4H3