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

Systemtic Name: [(E)-2-azanyl-3-oxidanyl-octadec-4-enyl] hexanoate Openeye Name: [(E)-2-amino-3-hydroxy-octadec-4-enyl] hexanoate CAS Name: hexanoic acid [(E)-2-amino-3-hydroxyoctadec-4-enyl] ester IUPAC Name: [(E)-2-amino-3-hydroxyoctadec-4-enyl] hexanoate Traditional Name: hexanoic acid [(E)-2-amino-3-hydroxy-octadec-4-enyl] ester Formula: C24H47NO3 MolecularWeight: 397.63488

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H47NO3/c1-3-5-7-8-9-10-11-12-13-14-15-16-18-19-23(26)22(25)21-28-24(27)20-17-6-4-2/h18-19,22-23,26H,3-17,20-21,25H2,1-2H3/b19-18+