(4-nitrophenyl)methyl (2S,4R)-2-[2-(dimethylamino)-1-methoxy-2-oxidanylidene-ethyl]-4-methylsulfonyloxy-pyrrolidine-1-carboxylate

Systemtic Name: (4-nitrophenyl)methyl (2S,4R)-2-[2-(dimethylamino)-1-methoxy-2-oxidanylidene-ethyl]-4-methylsulfonyloxy-pyrrolidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl (2S,4R)-2-[2-(dimethylamino)-1-methoxy-2-oxo-ethyl]-4-methylsulfonyloxy-pyrrolidine-1-carboxylate CAS Name: (2S,4R)-2-[2-(dimethylamino)-1-methoxy-2-oxoethyl]-4-methylsulfonyloxy-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl (2S,4R)-2-[2-(dimethylamino)-1-methoxy-2-oxoethyl]-4-methylsulfonyloxypyrrolidine-1-carboxylate Traditional Name: (2S,4R)-2-[2-(dimethylamino)-2-keto-1-methoxy-ethyl]-4-methylsulfonyloxy-pyrrolidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C18H25N3O9S MolecularWeight: 459.4708

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C(C1CC(CN1C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])OS(=O)(=O)C)OC

Isomeric SMILES

CN(C)C(=O)C([C@@H]1C[C@H](CN1C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])OS(=O)(=O)C)OC

InChI

InChI=1S/C18H25N3O9S/c1-19(2)17(22)16(28-3)15-9-14(30-31(4,26)27)10-20(15)18(23)29-11-12-5-7-13(8-6-12)21(24)25/h5-8,14-16H,9-11H2,1-4H3/t14-,15+,16?/m1/s1