(4-nitrophenyl)methyl 4-methylsulfonyloxy-2-[(2-oxidanylideneimidazolidin-1-yl)methyl]pyrrolidine-1-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 4-methylsulfonyloxy-2-[(2-oxidanylideneimidazolidin-1-yl)methyl]pyrrolidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl 4-methylsulfonyloxy-2-[(2-oxoimidazolidin-1-yl)methyl]pyrrolidine-1-carboxylate CAS Name: 4-methylsulfonyloxy-2-[(2-oxo-1-imidazolidinyl)methyl]-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 4-methylsulfonyloxy-2-[(2-oxoimidazolidin-1-yl)methyl]pyrrolidine-1-carboxylate Traditional Name: 2-[(2-ketoimidazolidin-1-yl)methyl]-4-methylsulfonyloxy-pyrrolidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C17H22N4O8S MolecularWeight: 442.44358

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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-])CN3CCNC3=O

Isomeric SMILES

CS(=O)(=O)OC1CC(N(C1)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])CN3CCNC3=O

InChI

InChI=1S/C17H22N4O8S/c1-30(26,27)29-15-8-14(9-19-7-6-18-16(19)22)20(10-15)17(23)28-11-12-2-4-13(5-3-12)21(24)25/h2-5,14-15H,6-11H2,1H3,(H,18,22)