3-butyl-6-(4-pentylphenyl)oxan-2-one

Systemtic Name: 3-butyl-6-(4-pentylphenyl)oxan-2-one Openeye Name: 3-butyl-6-(4-pentylphenyl)tetrahydropyran-2-one CAS Name: 3-butyl-6-(4-pentylphenyl)-2-oxanone IUPAC Name: 3-butyl-6-(4-pentylphenyl)oxan-2-one Traditional Name: 6-(4-amylphenyl)-3-butyl-tetrahydropyran-2-one Formula: C20H30O2 MolecularWeight: 302.451

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C2CCC(C(=O)O2)CCCC

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C2CCC(C(=O)O2)CCCC

InChI

InChI=1S/C20H30O2/c1-3-5-7-8-16-10-12-17(13-11-16)19-15-14-18(9-6-4-2)20(21)22-19/h10-13,18-19H,3-9,14-15H2,1-2H3