3-[8-(4-heptylphenyl)octyl]oxan-2-one

Systemtic Name: 3-[8-(4-heptylphenyl)octyl]oxan-2-one Openeye Name: 3-[8-(4-heptylphenyl)octyl]tetrahydropyran-2-one CAS Name: 3-[8-(4-heptylphenyl)octyl]-2-oxanone IUPAC Name: 3-[8-(4-heptylphenyl)octyl]oxan-2-one Traditional Name: 3-[8-(4-heptylphenyl)octyl]tetrahydropyran-2-one Formula: C26H42O2 MolecularWeight: 386.61048

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)CCCCCCCCC2CCCOC2=O

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)CCCCCCCCC2CCCOC2=O

InChI

InChI=1S/C26H42O2/c1-2-3-4-7-10-14-23-18-20-24(21-19-23)15-11-8-5-6-9-12-16-25-17-13-22-28-26(25)27/h18-21,25H,2-17,22H2,1H3