[(E,2S,3R)-2-acetamido-3-acetyloxy-heptadec-4-enyl] ethanoate

Systemtic Name: [(E,2S,3R)-2-acetamido-3-acetyloxy-heptadec-4-enyl] ethanoate Openeye Name: [(E,2S,3R)-2-acetamido-3-acetoxy-heptadec-4-enyl] acetate CAS Name: acetic acid [(E,2S,3R)-2-acetamido-3-acetyloxyheptadec-4-enyl] ester IUPAC Name: [(E,2S,3R)-2-acetamido-3-acetyloxyheptadec-4-enyl] acetate Traditional Name: acetic acid [(E,2S,3R)-2-acetamido-3-acetoxy-heptadec-4-enyl] ester Formula: C23H41NO5 MolecularWeight: 411.57534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC=CC(C(COC(=O)C)NC(=O)C)OC(=O)C

Isomeric SMILES

CCCCCCCCCCCC/C=C/[C@H]([C@H](COC(=O)C)NC(=O)C)OC(=O)C

InChI

InChI=1S/C23H41NO5/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-23(29-21(4)27)22(24-19(2)25)18-28-20(3)26/h16-17,22-23H,5-15,18H2,1-4H3,(H,24,25)/b17-16+/t22-,23+/m0/s1