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

Systemtic Name: ethyl (4S,5R)-5-methyl-2-oxidanidyl-4-oxidanyl-5-phenyl-4H-1,2-oxazol-2-ium-3-carboxylate Openeye Name: ethyl (4S,5R)-4-hydroxy-5-methyl-2-oxido-5-phenyl-4H-isoxazol-2-ium-3-carboxylate CAS Name: (4S,5R)-4-hydroxy-5-methyl-2-oxido-5-phenyl-4H-isoxazol-2-ium-3-carboxylic acid ethyl ester IUPAC Name: ethyl (4S,5R)-4-hydroxy-5-methyl-2-oxido-5-phenyl-4H-1,2-oxazol-2-ium-3-carboxylate Traditional Name: (4S,5R)-4-hydroxy-5-methyl-2-oxido-5-phenyl-2-isoxazolin-2-ium-3-carboxylic acid ethyl ester Formula: C13H15NO5 MolecularWeight: 265.2619

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=[N+](OC(C1O)(C)C2=CC=CC=C2)[O-]

Isomeric SMILES

CCOC(=O)C1=[N+](O[C@]([C@H]1O)(C)C2=CC=CC=C2)[O-]

InChI

InChI=1S/C13H15NO5/c1-3-18-12(16)10-11(15)13(2,19-14(10)17)9-7-5-4-6-8-9/h4-8,11,15H,3H2,1-2H3/t11-,13+/m0/s1