[(3R,4S)-4-azido-1-[2-(2-oxidanylethanoyl)phenyl]-5-oxidanylidene-pyrrolidin-3-yl] methanesulfonate

Systemtic Name: [(3R,4S)-4-azido-1-[2-(2-oxidanylethanoyl)phenyl]-5-oxidanylidene-pyrrolidin-3-yl] methanesulfonate Openeye Name: [(3R,4S)-4-azido-1-[2-(2-hydroxyacetyl)phenyl]-5-oxo-pyrrolidin-3-yl] methanesulfonate CAS Name: methanesulfonic acid [(3R,4S)-4-azido-1-[2-(2-hydroxy-1-oxoethyl)phenyl]-5-oxo-3-pyrrolidinyl] ester IUPAC Name: [(3R,4S)-4-azido-1-[2-(2-hydroxyacetyl)phenyl]-5-oxopyrrolidin-3-yl] methanesulfonate Traditional Name: methanesulfonic acid [(3R,4S)-4-azido-1-(2-glycoloylphenyl)-5-keto-pyrrolidin-3-yl] ester Formula: C13H14N4O6S MolecularWeight: 354.33846

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1CN(C(=O)C1N=[N+]=[N-])C2=CC=CC=C2C(=O)CO

Isomeric SMILES

CS(=O)(=O)O[C@@H]1CN(C(=O)[C@H]1N=[N+]=[N-])C2=CC=CC=C2C(=O)CO

InChI

InChI=1S/C13H14N4O6S/c1-24(21,22)23-11-6-17(13(20)12(11)15-16-14)9-5-3-2-4-8(9)10(19)7-18/h2-5,11-12,18H,6-7H2,1H3/t11-,12+/m1/s1