4,4-dimethyl-3-(13-oxidanyltridecyl)cyclohex-2-en-1-one

Systemtic Name: 4,4-dimethyl-3-(13-oxidanyltridecyl)cyclohex-2-en-1-one Openeye Name: 3-(13-hydroxytridecyl)-4,4-dimethyl-cyclohex-2-en-1-one CAS Name: 3-(13-hydroxytridecyl)-4,4-dimethyl-1-cyclohex-2-enone IUPAC Name: 3-(13-hydroxytridecyl)-4,4-dimethylcyclohex-2-en-1-one Traditional Name: 3-(13-hydroxytridecyl)-4,4-dimethyl-cyclohex-2-en-1-one Formula: C21H38O2 MolecularWeight: 322.52522

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(=O)C=C1CCCCCCCCCCCCCO)C

Isomeric SMILES

CC1(CCC(=O)C=C1CCCCCCCCCCCCCO)C

InChI

InChI=1S/C21H38O2/c1-21(2)16-15-20(23)18-19(21)14-12-10-8-6-4-3-5-7-9-11-13-17-22/h18,22H,3-17H2,1-2H3