[(E,2S,3R)-2-azanyl-3-oxidanyl-octadec-4-enyl] methanesulfonate

Systemtic Name: [(E,2S,3R)-2-azanyl-3-oxidanyl-octadec-4-enyl] methanesulfonate Openeye Name: [(E,2S,3R)-2-amino-3-hydroxy-octadec-4-enyl] methanesulfonate CAS Name: methanesulfonic acid [(E,2S,3R)-2-amino-3-hydroxyoctadec-4-enyl] ester IUPAC Name: [(E,2S,3R)-2-amino-3-hydroxyoctadec-4-enyl] methanesulfonate Traditional Name: methanesulfonic acid [(E,2S,3R)-2-amino-3-hydroxy-octadec-4-enyl] ester Formula: C19H39NO4S MolecularWeight: 377.58226

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCCCCCCCCCC/C=C/[C@H]([C@H](COS(=O)(=O)C)N)O

InChI

InChI=1S/C19H39NO4S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19(21)18(20)17-24-25(2,22)23/h15-16,18-19,21H,3-14,17,20H2,1-2H3/b16-15+/t18-,19+/m0/s1