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

Systemtic Name: 6-(4-methylphenyl)-3-pentyl-oxan-2-one Openeye Name: 3-pentyl-6-(p-tolyl)tetrahydropyran-2-one CAS Name: 6-(4-methylphenyl)-3-pentyl-2-oxanone IUPAC Name: 6-(4-methylphenyl)-3-pentyloxan-2-one Traditional Name: 3-amyl-6-(p-tolyl)tetrahydropyran-2-one Formula: C17H24O2 MolecularWeight: 260.37126

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(OC1=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCCC1CCC(OC1=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C17H24O2/c1-3-4-5-6-15-11-12-16(19-17(15)18)14-9-7-13(2)8-10-14/h7-10,15-16H,3-6,11-12H2,1-2H3