(4-nitrophenyl)methyl 2-(3-azanyl-1,2,4-oxadiazol-5-yl)-4-methylsulfonyloxy-pyrrolidine-1-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 2-(3-azanyl-1,2,4-oxadiazol-5-yl)-4-methylsulfonyloxy-pyrrolidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl 2-(3-amino-1,2,4-oxadiazol-5-yl)-4-methylsulfonyloxy-pyrrolidine-1-carboxylate CAS Name: 2-(3-amino-1,2,4-oxadiazol-5-yl)-4-methylsulfonyloxy-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-(3-amino-1,2,4-oxadiazol-5-yl)-4-methylsulfonyloxypyrrolidine-1-carboxylate Traditional Name: 2-(3-amino-1,2,4-oxadiazol-5-yl)-4-methylsulfonyloxy-pyrrolidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C15H17N5O8S MolecularWeight: 427.38918

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1CC(N(C1)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])C3=NC(=NO3)N

Isomeric SMILES

CS(=O)(=O)OC1CC(N(C1)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])C3=NC(=NO3)N

InChI

InChI=1S/C15H17N5O8S/c1-29(24,25)28-11-6-12(13-17-14(16)18-27-13)19(7-11)15(21)26-8-9-2-4-10(5-3-9)20(22)23/h2-5,11-12H,6-8H2,1H3,(H2,16,18)