[(E)-2-azanyl-3-oxidanyl-octadec-4-enyl] butanoate

Systemtic Name: [(E)-2-azanyl-3-oxidanyl-octadec-4-enyl] butanoate Openeye Name: [(E)-2-amino-3-hydroxy-octadec-4-enyl] butanoate CAS Name: butanoic acid [(E)-2-amino-3-hydroxyoctadec-4-enyl] ester IUPAC Name: [(E)-2-amino-3-hydroxyoctadec-4-enyl] butanoate Traditional Name: butyric acid [(E)-2-amino-3-hydroxy-octadec-4-enyl] ester Formula: C22H43NO3 MolecularWeight: 369.58172

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC=CC(C(COC(=O)CCC)N)O

Isomeric SMILES

CCCCCCCCCCCCC/C=C/C(C(COC(=O)CCC)N)O

InChI

InChI=1S/C22H43NO3/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-18-21(24)20(23)19-26-22(25)17-4-2/h16,18,20-21,24H,3-15,17,19,23H2,1-2H3/b18-16+