[(1S)-1-[(4E)-4-nonylidene-5-oxidanylidene-oxolan-2-yl]-2-oxidanyl-ethyl] nonanoate

Systemtic Name: [(1S)-1-[(4E)-4-nonylidene-5-oxidanylidene-oxolan-2-yl]-2-oxidanyl-ethyl] nonanoate Openeye Name: [(1S)-2-hydroxy-1-[(4E)-4-nonylidene-5-oxo-tetrahydrofuran-2-yl]ethyl] nonanoate CAS Name: nonanoic acid [(1S)-2-hydroxy-1-[(4E)-4-nonylidene-5-oxo-2-oxolanyl]ethyl] ester IUPAC Name: [(1S)-2-hydroxy-1-[(4E)-4-nonylidene-5-oxooxolan-2-yl]ethyl] nonanoate Traditional Name: pelargonic acid [(1S)-2-hydroxy-1-[(4E)-5-keto-4-nonylidene-tetrahydrofuran-2-yl]ethyl] ester Formula: C24H42O5 MolecularWeight: 410.58728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=C1CC(OC1=O)C(CO)OC(=O)CCCCCCCC

Isomeric SMILES

CCCCCCCC/C=C/1\CC(OC1=O)[C@H](CO)OC(=O)CCCCCCCC

InChI

InChI=1S/C24H42O5/c1-3-5-7-9-11-12-14-16-20-18-21(29-24(20)27)22(19-25)28-23(26)17-15-13-10-8-6-4-2/h16,21-22,25H,3-15,17-19H2,1-2H3/b20-16+/t21?,22-/m0/s1