2-[(4S,5R)-2-oxidanylidene-5-[(E)-pentadec-1-enyl]-1,3-oxazolidin-4-yl]ethyl methanesulfonate

Systemtic Name: 2-[(4S,5R)-2-oxidanylidene-5-[(E)-pentadec-1-enyl]-1,3-oxazolidin-4-yl]ethyl methanesulfonate Openeye Name: 2-[(4S,5R)-2-oxo-5-[(E)-pentadec-1-enyl]oxazolidin-4-yl]ethyl methanesulfonate CAS Name: methanesulfonic acid 2-[(4S,5R)-2-oxo-5-[(E)-pentadec-1-enyl]-4-oxazolidinyl]ethyl ester IUPAC Name: 2-[(4S,5R)-2-oxo-5-[(E)-pentadec-1-enyl]-1,3-oxazolidin-4-yl]ethyl methanesulfonate Traditional Name: methanesulfonic acid 2-[(4S,5R)-2-keto-5-[(E)-pentadec-1-enyl]oxazolidin-4-yl]ethyl ester Formula: C21H39NO5S MolecularWeight: 417.60306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC=CC1C(NC(=O)O1)CCOS(=O)(=O)C

Isomeric SMILES

CCCCCCCCCCCCC/C=C/[C@@H]1[C@@H](NC(=O)O1)CCOS(=O)(=O)C

InChI

InChI=1S/C21H39NO5S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-19(22-21(23)27-20)17-18-26-28(2,24)25/h15-16,19-20H,3-14,17-18H2,1-2H3,(H,22,23)/b16-15+/t19-,20+/m0/s1