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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(CC1=CC(=O)CCC1(C)C)O

Isomeric SMILES

CCCCCCCCCCCC(CC1=CC(=O)CCC1(C)C)O

InChI

InChI=1S/C21H38O2/c1-4-5-6-7-8-9-10-11-12-13-19(22)16-18-17-20(23)14-15-21(18,2)3/h17,19,22H,4-16H2,1-3H3