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

Systemtic Name: (4-nitrophenyl)methyl 2-[2-(aminocarbonylamino)ethoxymethyl]-4-methylsulfonyloxy-pyrrolidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl 4-methylsulfonyloxy-2-(2-ureidoethoxymethyl)pyrrolidine-1-carboxylate CAS Name: 2-[2-(carbamoylamino)ethoxymethyl]-4-methylsulfonyloxy-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-[2-(carbamoylamino)ethoxymethyl]-4-methylsulfonyloxypyrrolidine-1-carboxylate Traditional Name: 4-methylsulfonyloxy-2-(2-ureidoethoxymethyl)pyrrolidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C17H24N4O9S MolecularWeight: 460.45886

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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-])COCCNC(=O)N

Isomeric SMILES

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

InChI

InChI=1S/C17H24N4O9S/c1-31(26,27)30-15-8-14(11-28-7-6-19-16(18)22)20(9-15)17(23)29-10-12-2-4-13(5-3-12)21(24)25/h2-5,14-15H,6-11H2,1H3,(H3,18,19,22)