(4-nitrophenyl)methyl 2-(4-aminocarbonyl-1,3-thiazol-2-yl)-4-methylsulfonyloxy-pyrrolidine-1-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 2-(4-aminocarbonyl-1,3-thiazol-2-yl)-4-methylsulfonyloxy-pyrrolidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl 2-(4-carbamoylthiazol-2-yl)-4-methylsulfonyloxy-pyrrolidine-1-carboxylate CAS Name: 2-(4-carbamoyl-2-thiazolyl)-4-methylsulfonyloxy-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-(4-carbamoyl-1,3-thiazol-2-yl)-4-methylsulfonyloxypyrrolidine-1-carboxylate Traditional Name: 2-(4-carbamoylthiazol-2-yl)-4-methylsulfonyloxy-pyrrolidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C17H18N4O8S2 MolecularWeight: 470.47682

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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(=CS3)C(=O)N

Isomeric SMILES

CS(=O)(=O)OC1CC(N(C1)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])C3=NC(=CS3)C(=O)N

InChI

InChI=1S/C17H18N4O8S2/c1-31(26,27)29-12-6-14(16-19-13(9-30-16)15(18)22)20(7-12)17(23)28-8-10-2-4-11(5-3-10)21(24)25/h2-5,9,12,14H,6-8H2,1H3,(H2,18,22)