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

Systemtic Name: [(E)-2-azanyl-3-oxidanyl-octadec-4-enyl] dodecanoate Openeye Name: [(E)-2-amino-3-hydroxy-octadec-4-enyl] dodecanoate CAS Name: dodecanoic acid [(E)-2-amino-3-hydroxyoctadec-4-enyl] ester IUPAC Name: [(E)-2-amino-3-hydroxyoctadec-4-enyl] dodecanoate Traditional Name: lauric acid [(E)-2-amino-3-hydroxy-octadec-4-enyl] ester Formula: C30H59NO3 MolecularWeight: 481.79436

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H59NO3/c1-3-5-7-9-11-13-14-15-16-18-19-21-23-25-29(32)28(31)27-34-30(33)26-24-22-20-17-12-10-8-6-4-2/h23,25,28-29,32H,3-22,24,26-27,31H2,1-2H3/b25-23+