3-octyl-6-phenyl-oxan-2-one

Systemtic Name: 3-octyl-6-phenyl-oxan-2-one Openeye Name: 3-octyl-6-phenyl-tetrahydropyran-2-one CAS Name: 3-octyl-6-phenyl-2-oxanone IUPAC Name: 3-octyl-6-phenyloxan-2-one Traditional Name: 3-octyl-6-phenyl-tetrahydropyran-2-one Formula: C19H28O2 MolecularWeight: 288.42442

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1CCC(OC1=O)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCC1CCC(OC1=O)C2=CC=CC=C2

InChI

InChI=1S/C19H28O2/c1-2-3-4-5-6-8-13-17-14-15-18(21-19(17)20)16-11-9-7-10-12-16/h7,9-12,17-18H,2-6,8,13-15H2,1H3