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

Systemtic Name: 3-(4-chlorophenyl)-6-octyl-oxan-2-one Openeye Name: 3-(4-chlorophenyl)-6-octyl-tetrahydropyran-2-one CAS Name: 3-(4-chlorophenyl)-6-octyl-2-oxanone IUPAC Name: 3-(4-chlorophenyl)-6-octyloxan-2-one Traditional Name: 3-(4-chlorophenyl)-6-octyl-tetrahydropyran-2-one Formula: C19H27ClO2 MolecularWeight: 322.86948

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H27ClO2/c1-2-3-4-5-6-7-8-17-13-14-18(19(21)22-17)15-9-11-16(20)12-10-15/h9-12,17-18H,2-8,13-14H2,1H3