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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(C(=O)O1)C2=CC=C(C=C2)OCC

Isomeric SMILES

CCCCCCCC1CCC(C(=O)O1)C2=CC=C(C=C2)OCC

InChI

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