3-(4-ethoxyphenyl)-6-octyl-oxan-2-one

Systemtic Name: 3-(4-ethoxyphenyl)-6-octyl-oxan-2-one Openeye Name: 3-(4-ethoxyphenyl)-6-octyl-tetrahydropyran-2-one CAS Name: 3-(4-ethoxyphenyl)-6-octyl-2-oxanone IUPAC Name: 3-(4-ethoxyphenyl)-6-octyloxan-2-one Traditional Name: 6-octyl-3-p-phenetyl-tetrahydropyran-2-one Formula: C21H32O3 MolecularWeight: 332.47698

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1CCC(C(=O)O1)C2=CC=C(C=C2)OCC

Isomeric SMILES

CCCCCCCCC1CCC(C(=O)O1)C2=CC=C(C=C2)OCC

InChI

InChI=1S/C21H32O3/c1-3-5-6-7-8-9-10-19-15-16-20(21(22)24-19)17-11-13-18(14-12-17)23-4-2/h11-14,19-20H,3-10,15-16H2,1-2H3