(4-nitrophenyl)methyl 2-(methylsulfonylaminomethyl)-4-methylsulfonyloxy-pyrrolidine-1-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 2-(methylsulfonylaminomethyl)-4-methylsulfonyloxy-pyrrolidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl 2-(methanesulfonamidomethyl)-4-methylsulfonyloxy-pyrrolidine-1-carboxylate CAS Name: 2-(methanesulfonamidomethyl)-4-methylsulfonyloxy-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-(methanesulfonamidomethyl)-4-methylsulfonyloxypyrrolidine-1-carboxylate Traditional Name: 2-(methanesulfonamidomethyl)-4-methylsulfonyloxy-pyrrolidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C15H21N3O9S2 MolecularWeight: 451.47194

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NCC1CC(CN1C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])OS(=O)(=O)C

Isomeric SMILES

CS(=O)(=O)NCC1CC(CN1C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])OS(=O)(=O)C

InChI

InChI=1S/C15H21N3O9S2/c1-28(22,23)16-8-13-7-14(27-29(2,24)25)9-17(13)15(19)26-10-11-3-5-12(6-4-11)18(20)21/h3-6,13-14,16H,7-10H2,1-2H3