(phenylmethyl) (2R)-2-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]carbamoyl]pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) (2R)-2-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]carbamoyl]pyrrolidine-1-carboxylate Openeye Name: benzyl (2R)-2-[[4-(3-nitrophenyl)thiazol-2-yl]carbamoyl]pyrrolidine-1-carboxylate CAS Name: (2R)-2-[[[4-(3-nitrophenyl)-2-thiazolyl]amino]-oxomethyl]-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2R)-2-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]carbamoyl]pyrrolidine-1-carboxylate Traditional Name: (2R)-2-[[4-(3-nitrophenyl)thiazol-2-yl]carbamoyl]pyrrolidine-1-carboxylic acid benzyl ester Formula: C22H20N4O5S MolecularWeight: 452.483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)OCC2=CC=CC=C2)C(=O)NC3=NC(=CS3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1C[C@@H](N(C1)C(=O)OCC2=CC=CC=C2)C(=O)NC3=NC(=CS3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H20N4O5S/c27-20(19-10-5-11-25(19)22(28)31-13-15-6-2-1-3-7-15)24-21-23-18(14-32-21)16-8-4-9-17(12-16)26(29)30/h1-4,6-9,12,14,19H,5,10-11,13H2,(H,23,24,27)/t19-/m1/s1