(4-nitrophenyl)methyl 2-(3-methyl-2-oxidanylidene-imidazolidin-1-yl)carbonyl-4-methylsulfonyloxy-pyrrolidine-1-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 2-(3-methyl-2-oxidanylidene-imidazolidin-1-yl)carbonyl-4-methylsulfonyloxy-pyrrolidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl 2-(3-methyl-2-oxo-imidazolidine-1-carbonyl)-4-methylsulfonyloxy-pyrrolidine-1-carboxylate CAS Name: 2-[(3-methyl-2-oxo-1-imidazolidinyl)-oxomethyl]-4-methylsulfonyloxy-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-(3-methyl-2-oxoimidazolidine-1-carbonyl)-4-methylsulfonyloxypyrrolidine-1-carboxylate Traditional Name: 2-(2-keto-3-methyl-imidazolidine-1-carbonyl)-4-methylsulfonyloxy-pyrrolidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C18H22N4O9S MolecularWeight: 470.45368

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(C1=O)C(=O)C2CC(CN2C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])OS(=O)(=O)C

Isomeric SMILES

CN1CCN(C1=O)C(=O)C2CC(CN2C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])OS(=O)(=O)C

InChI

InChI=1S/C18H22N4O9S/c1-19-7-8-20(17(19)24)16(23)15-9-14(31-32(2,28)29)10-21(15)18(25)30-11-12-3-5-13(6-4-12)22(26)27/h3-6,14-15H,7-11H2,1-2H3