(4-nitrophenyl)methyl 4-methylsulfonyloxy-2-(5-oxidanylidenepyrrolidin-3-yl)pyrrolidine-1-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 4-methylsulfonyloxy-2-(5-oxidanylidenepyrrolidin-3-yl)pyrrolidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl 4-methylsulfonyloxy-2-(5-oxopyrrolidin-3-yl)pyrrolidine-1-carboxylate CAS Name: 4-methylsulfonyloxy-2-(5-oxo-3-pyrrolidinyl)-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 4-methylsulfonyloxy-2-(5-oxopyrrolidin-3-yl)pyrrolidine-1-carboxylate Traditional Name: 2-(5-ketopyrrolidin-3-yl)-4-methylsulfonyloxy-pyrrolidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C17H21N3O8S MolecularWeight: 427.42894

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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-])C3CC(=O)NC3

Isomeric SMILES

CS(=O)(=O)OC1CC(N(C1)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])C3CC(=O)NC3

InChI

InChI=1S/C17H21N3O8S/c1-29(25,26)28-14-7-15(12-6-16(21)18-8-12)19(9-14)17(22)27-10-11-2-4-13(5-3-11)20(23)24/h2-5,12,14-15H,6-10H2,1H3,(H,18,21)