ethyl 2-[(2S,4R)-4-methylsulfonyloxy-1-[(4-nitrophenyl)methoxycarbonyl]pyrrolidin-2-yl]-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 2-[(2S,4R)-4-methylsulfonyloxy-1-[(4-nitrophenyl)methoxycarbonyl]pyrrolidin-2-yl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[(2S,4R)-4-methylsulfonyloxy-1-[(4-nitrophenyl)methoxycarbonyl]pyrrolidin-2-yl]thiazole-4-carboxylate CAS Name: 2-[(2S,4R)-4-methylsulfonyloxy-1-[(4-nitrophenyl)methoxy-oxomethyl]-2-pyrrolidinyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2S,4R)-4-methylsulfonyloxy-1-[(4-nitrophenyl)methoxycarbonyl]pyrrolidin-2-yl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[(2S,4R)-4-methylsulfonyloxy-1-(4-nitrobenzyl)oxycarbonyl-pyrrolidin-2-yl]thiazole-4-carboxylic acid ethyl ester Formula: C19H21N3O9S2 MolecularWeight: 499.51474

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)C2CC(CN2C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])OS(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)[C@@H]2C[C@H](CN2C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])OS(=O)(=O)C

InChI

InChI=1S/C19H21N3O9S2/c1-3-29-18(23)15-11-32-17(20-15)16-8-14(31-33(2,27)28)9-21(16)19(24)30-10-12-4-6-13(7-5-12)22(25)26/h4-7,11,14,16H,3,8-10H2,1-2H3/t14-,16+/m1/s1