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

Systemtic Name: 5-hexyl-4-methyl-4-oxidanyl-cyclopent-2-en-1-one Openeye Name: 5-hexyl-4-hydroxy-4-methyl-cyclopent-2-en-1-one CAS Name: 5-hexyl-4-hydroxy-4-methyl-1-cyclopent-2-enone IUPAC Name: 5-hexyl-4-hydroxy-4-methylcyclopent-2-en-1-one Traditional Name: 5-hexyl-4-hydroxy-4-methyl-cyclopent-2-en-1-one Formula: C12H20O2 MolecularWeight: 196.286

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1C(=O)C=CC1(C)O

Isomeric SMILES

CCCCCCC1C(=O)C=CC1(C)O

InChI

InChI=1S/C12H20O2/c1-3-4-5-6-7-10-11(13)8-9-12(10,2)14/h8-10,14H,3-7H2,1-2H3