5-heptyl-4-methyl-4-oxidanyl-cyclopent-2-en-1-one

Systemtic Name: 5-heptyl-4-methyl-4-oxidanyl-cyclopent-2-en-1-one Openeye Name: 5-heptyl-4-hydroxy-4-methyl-cyclopent-2-en-1-one CAS Name: 5-heptyl-4-hydroxy-4-methyl-1-cyclopent-2-enone IUPAC Name: 5-heptyl-4-hydroxy-4-methylcyclopent-2-en-1-one Traditional Name: 5-heptyl-4-hydroxy-4-methyl-cyclopent-2-en-1-one Formula: C13H22O2 MolecularWeight: 210.31258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1C(=O)C=CC1(C)O

Isomeric SMILES

CCCCCCCC1C(=O)C=CC1(C)O

InChI

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