3-[6-(4-pentylphenyl)hexyl]oxan-2-one

Systemtic Name: 3-[6-(4-pentylphenyl)hexyl]oxan-2-one Openeye Name: 3-[6-(4-pentylphenyl)hexyl]tetrahydropyran-2-one CAS Name: 3-[6-(4-pentylphenyl)hexyl]-2-oxanone IUPAC Name: 3-[6-(4-pentylphenyl)hexyl]oxan-2-one Traditional Name: 3-[6-(4-amylphenyl)hexyl]tetrahydropyran-2-one Formula: C22H34O2 MolecularWeight: 330.50416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)CCCCCCC2CCCOC2=O

Isomeric SMILES

CCCCCC1=CC=C(C=C1)CCCCCCC2CCCOC2=O

InChI

InChI=1S/C22H34O2/c1-2-3-6-10-19-14-16-20(17-15-19)11-7-4-5-8-12-21-13-9-18-24-22(21)23/h14-17,21H,2-13,18H2,1H3