(4-nitrophenyl)methyl 2-[2-(methylsulfonylamino)ethoxymethyl]-4-methylsulfonyloxy-pyrrolidine-1-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 2-[2-(methylsulfonylamino)ethoxymethyl]-4-methylsulfonyloxy-pyrrolidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl 2-[2-(methanesulfonamido)ethoxymethyl]-4-methylsulfonyloxy-pyrrolidine-1-carboxylate CAS Name: 2-[2-(methanesulfonamido)ethoxymethyl]-4-methylsulfonyloxy-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-[2-(methanesulfonamido)ethoxymethyl]-4-methylsulfonyloxypyrrolidine-1-carboxylate Traditional Name: 2-[2-(methanesulfonamido)ethoxymethyl]-4-methylsulfonyloxy-pyrrolidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C17H25N3O10S2 MolecularWeight: 495.5245

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NCCOCC1CC(CN1C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])OS(=O)(=O)C

Isomeric SMILES

CS(=O)(=O)NCCOCC1CC(CN1C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])OS(=O)(=O)C

InChI

InChI=1S/C17H25N3O10S2/c1-31(24,25)18-7-8-28-12-15-9-16(30-32(2,26)27)10-19(15)17(21)29-11-13-3-5-14(6-4-13)20(22)23/h3-6,15-16,18H,7-12H2,1-2H3