2-methylpropyl [(9E,12E)-octadeca-9,12-dienyl] carbonate

Systemtic Name: 2-methylpropyl [(9E,12E)-octadeca-9,12-dienyl] carbonate Openeye Name: isobutyl [(9E,12E)-octadeca-9,12-dienyl] carbonate CAS Name: carbonic acid 2-methylpropyl [(9E,12E)-octadeca-9,12-dienyl] ester IUPAC Name: 2-methylpropyl [(9E,12E)-octadeca-9,12-dienyl] carbonate Traditional Name: carbonic acid isobutyl [(9E,12E)-octadeca-9,12-dienyl] ester Formula: C23H42O3 MolecularWeight: 366.57778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCC=CCCCCCCCCOC(=O)OCC(C)C

Isomeric SMILES

CCCCC/C=C/C/C=C/CCCCCCCCOC(=O)OCC(C)C

InChI

InChI=1S/C23H42O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25-23(24)26-21-22(2)3/h8-9,11-12,22H,4-7,10,13-21H2,1-3H3/b9-8+,12-11+