3-hexyl-6-(4-methylphenyl)oxan-2-one

Systemtic Name: 3-hexyl-6-(4-methylphenyl)oxan-2-one Openeye Name: 3-hexyl-6-(p-tolyl)tetrahydropyran-2-one CAS Name: 3-hexyl-6-(4-methylphenyl)-2-oxanone IUPAC Name: 3-hexyl-6-(4-methylphenyl)oxan-2-one Traditional Name: 3-hexyl-6-(p-tolyl)tetrahydropyran-2-one Formula: C18H26O2 MolecularWeight: 274.39784

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CCC(OC1=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCCCC1CCC(OC1=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C18H26O2/c1-3-4-5-6-7-16-12-13-17(20-18(16)19)15-10-8-14(2)9-11-15/h8-11,16-17H,3-7,12-13H2,1-2H3