(4-nitrophenyl)methyl 2-[2-(aminocarbonyloxymethyl)-1,3-thiazol-4-yl]-4-methylsulfonyloxy-pyrrolidine-1-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 2-[2-(aminocarbonyloxymethyl)-1,3-thiazol-4-yl]-4-methylsulfonyloxy-pyrrolidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl 2-[2-(carbamoyloxymethyl)thiazol-4-yl]-4-methylsulfonyloxy-pyrrolidine-1-carboxylate CAS Name: 2-[2-(carbamoyloxymethyl)-4-thiazolyl]-4-methylsulfonyloxy-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-[2-(carbamoyloxymethyl)-1,3-thiazol-4-yl]-4-methylsulfonyloxypyrrolidine-1-carboxylate Traditional Name: 2-[2-(carbamoyloxymethyl)thiazol-4-yl]-4-methylsulfonyloxy-pyrrolidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C18H20N4O9S2 MolecularWeight: 500.5028

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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=CSC(=N3)COC(=O)N

Isomeric SMILES

CS(=O)(=O)OC1CC(N(C1)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])C3=CSC(=N3)COC(=O)N

InChI

InChI=1S/C18H20N4O9S2/c1-33(27,28)31-13-6-15(14-10-32-16(20-14)9-29-17(19)23)21(7-13)18(24)30-8-11-2-4-12(5-3-11)22(25)26/h2-5,10,13,15H,6-9H2,1H3,(H2,19,23)