ethyl (4S,5S)-5-(hydroxymethyl)-5-methyl-2-oxidanidyl-4-oxidanyl-4H-1,2-oxazol-2-ium-3-carboxylate

Systemtic Name: ethyl (4S,5S)-5-(hydroxymethyl)-5-methyl-2-oxidanidyl-4-oxidanyl-4H-1,2-oxazol-2-ium-3-carboxylate Openeye Name: ethyl (4S,5S)-4-hydroxy-5-(hydroxymethyl)-5-methyl-2-oxido-4H-isoxazol-2-ium-3-carboxylate CAS Name: (4S,5S)-4-hydroxy-5-(hydroxymethyl)-5-methyl-2-oxido-4H-isoxazol-2-ium-3-carboxylic acid ethyl ester IUPAC Name: ethyl (4S,5S)-4-hydroxy-5-(hydroxymethyl)-5-methyl-2-oxido-4H-1,2-oxazol-2-ium-3-carboxylate Traditional Name: (4S,5S)-4-hydroxy-5-methyl-5-methylol-2-oxido-2-isoxazolin-2-ium-3-carboxylic acid ethyl ester Formula: C8H13NO6 MolecularWeight: 219.19192

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=[N+](OC(C1O)(C)CO)[O-]

Isomeric SMILES

CCOC(=O)C1=[N+](O[C@@]([C@H]1O)(C)CO)[O-]

InChI

InChI=1S/C8H13NO6/c1-3-14-7(12)5-6(11)8(2,4-10)15-9(5)13/h6,10-11H,3-4H2,1-2H3/t6-,8-/m0/s1