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

Systemtic Name: 6-(4-ethoxyphenyl)-3-heptyl-oxan-2-one Openeye Name: 6-(4-ethoxyphenyl)-3-heptyl-tetrahydropyran-2-one CAS Name: 6-(4-ethoxyphenyl)-3-heptyl-2-oxanone IUPAC Name: 6-(4-ethoxyphenyl)-3-heptyloxan-2-one Traditional Name: 3-heptyl-6-p-phenetyl-tetrahydropyran-2-one Formula: C20H30O3 MolecularWeight: 318.4504

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(OC1=O)C2=CC=C(C=C2)OCC

Isomeric SMILES

CCCCCCCC1CCC(OC1=O)C2=CC=C(C=C2)OCC

InChI

InChI=1S/C20H30O3/c1-3-5-6-7-8-9-17-12-15-19(23-20(17)21)16-10-13-18(14-11-16)22-4-2/h10-11,13-14,17,19H,3-9,12,15H2,1-2H3