[(E,3S,4R)-3-acetamido-4-acetyloxy-nonadec-5-enyl] ethanoate

Systemtic Name: [(E,3S,4R)-3-acetamido-4-acetyloxy-nonadec-5-enyl] ethanoate Openeye Name: [(E,3S,4R)-3-acetamido-4-acetoxy-nonadec-5-enyl] acetate CAS Name: acetic acid [(E,3S,4R)-3-acetamido-4-acetyloxynonadec-5-enyl] ester IUPAC Name: [(E,3S,4R)-3-acetamido-4-acetyloxynonadec-5-enyl] acetate Traditional Name: acetic acid [(E,3S,4R)-3-acetamido-4-acetoxy-nonadec-5-enyl] ester Formula: C25H45NO5 MolecularWeight: 439.6285

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC=CC(C(CCOC(=O)C)NC(=O)C)OC(=O)C

Isomeric SMILES

CCCCCCCCCCCCC/C=C/[C@H]([C@H](CCOC(=O)C)NC(=O)C)OC(=O)C

InChI

InChI=1S/C25H45NO5/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-25(31-23(4)29)24(26-21(2)27)19-20-30-22(3)28/h17-18,24-25H,5-16,19-20H2,1-4H3,(H,26,27)/b18-17+/t24-,25+/m0/s1