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

Systemtic Name: [(E)-2-azanyl-3-oxidanyl-octadec-4-enyl] 2-oxidanylbutanoate Openeye Name: [(E)-2-amino-3-hydroxy-octadec-4-enyl] 2-hydroxybutanoate CAS Name: 2-hydroxybutanoic acid [(E)-2-amino-3-hydroxyoctadec-4-enyl] ester IUPAC Name: [(E)-2-amino-3-hydroxyoctadec-4-enyl] 2-hydroxybutanoate Traditional Name: 2-hydroxybutyric acid [(E)-2-amino-3-hydroxy-octadec-4-enyl] ester Formula: C22H43NO4 MolecularWeight: 385.58112

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H43NO4/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-21(25)19(23)18-27-22(26)20(24)4-2/h16-17,19-21,24-25H,3-15,18,23H2,1-2H3/b17-16+