3-[4-(4-pentylphenyl)butyl]oxan-2-one

Systemtic Name: 3-[4-(4-pentylphenyl)butyl]oxan-2-one Openeye Name: 3-[4-(4-pentylphenyl)butyl]tetrahydropyran-2-one CAS Name: 3-[4-(4-pentylphenyl)butyl]-2-oxanone IUPAC Name: 3-[4-(4-pentylphenyl)butyl]oxan-2-one Traditional Name: 3-[4-(4-amylphenyl)butyl]tetrahydropyran-2-one Formula: C20H30O2 MolecularWeight: 302.451

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)CCCCC2CCCOC2=O

Isomeric SMILES

CCCCCC1=CC=C(C=C1)CCCCC2CCCOC2=O

InChI

InChI=1S/C20H30O2/c1-2-3-4-8-17-12-14-18(15-13-17)9-5-6-10-19-11-7-16-22-20(19)21/h12-15,19H,2-11,16H2,1H3