5-(4-hexylphenyl)-3-pentyl-oxolan-2-one

Systemtic Name: 5-(4-hexylphenyl)-3-pentyl-oxolan-2-one Openeye Name: 5-(4-hexylphenyl)-3-pentyl-tetrahydrofuran-2-one CAS Name: 5-(4-hexylphenyl)-3-pentyl-2-oxolanone IUPAC Name: 5-(4-hexylphenyl)-3-pentyloxolan-2-one Traditional Name: 3-amyl-5-(4-hexylphenyl)tetrahydrofuran-2-one Formula: C21H32O2 MolecularWeight: 316.47758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C2CC(C(=O)O2)CCCCC

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C2CC(C(=O)O2)CCCCC

InChI

InChI=1S/C21H32O2/c1-3-5-7-9-10-17-12-14-18(15-13-17)20-16-19(21(22)23-20)11-8-6-4-2/h12-15,19-20H,3-11,16H2,1-2H3