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

Systemtic Name: 5-(4-octoxyphenyl)-3-pentyl-oxolan-2-one Openeye Name: 5-(4-octoxyphenyl)-3-pentyl-tetrahydrofuran-2-one CAS Name: 5-(4-octoxyphenyl)-3-pentyl-2-oxolanone IUPAC Name: 5-(4-octoxyphenyl)-3-pentyloxolan-2-one Traditional Name: 3-amyl-5-(4-octoxyphenyl)tetrahydrofuran-2-one Formula: C23H36O3 MolecularWeight: 360.53014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2CC(C(=O)O2)CCCCC

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2CC(C(=O)O2)CCCCC

InChI

InChI=1S/C23H36O3/c1-3-5-7-8-9-11-17-25-21-15-13-19(14-16-21)22-18-20(23(24)26-22)12-10-6-4-2/h13-16,20,22H,3-12,17-18H2,1-2H3