6-(4-octylphenyl)oxan-2-one

Systemtic Name: 6-(4-octylphenyl)oxan-2-one Openeye Name: 6-(4-octylphenyl)tetrahydropyran-2-one CAS Name: 6-(4-octylphenyl)-2-oxanone IUPAC Name: 6-(4-octylphenyl)oxan-2-one Traditional Name: 6-(4-octylphenyl)tetrahydropyran-2-one Formula: C19H28O2 MolecularWeight: 288.42442

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C2CCCC(=O)O2

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C2CCCC(=O)O2

InChI

InChI=1S/C19H28O2/c1-2-3-4-5-6-7-9-16-12-14-17(15-13-16)18-10-8-11-19(20)21-18/h12-15,18H,2-11H2,1H3