(4-nitrophenyl)methyl (2S,4R)-2-(4-aminocarbonyl-1,3-thiazol-2-yl)-4-oxidanyl-pyrrolidine-1-carboxylate

Systemtic Name: (4-nitrophenyl)methyl (2S,4R)-2-(4-aminocarbonyl-1,3-thiazol-2-yl)-4-oxidanyl-pyrrolidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl (2S,4R)-2-(4-carbamoylthiazol-2-yl)-4-hydroxy-pyrrolidine-1-carboxylate CAS Name: (2S,4R)-2-(4-carbamoyl-2-thiazolyl)-4-hydroxy-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl (2S,4R)-2-(4-carbamoyl-1,3-thiazol-2-yl)-4-hydroxypyrrolidine-1-carboxylate Traditional Name: (2S,4R)-2-(4-carbamoylthiazol-2-yl)-4-hydroxy-pyrrolidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C16H16N4O6S MolecularWeight: 392.38644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1C2=NC(=CS2)C(=O)N)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

C1[C@H](CN([C@@H]1C2=NC(=CS2)C(=O)N)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])O

InChI

InChI=1S/C16H16N4O6S/c17-14(22)12-8-27-15(18-12)13-5-11(21)6-19(13)16(23)26-7-9-1-3-10(4-2-9)20(24)25/h1-4,8,11,13,21H,5-7H2,(H2,17,22)/t11-,13+/m1/s1