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

Systemtic Name: (4-nitrophenyl)methyl 2-(4-aminocarbonyl-1,3-thiazol-2-yl)pyrrolidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl 2-(4-carbamoylthiazol-2-yl)pyrrolidine-1-carboxylate CAS Name: 2-(4-carbamoyl-2-thiazolyl)-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-(4-carbamoyl-1,3-thiazol-2-yl)pyrrolidine-1-carboxylate Traditional Name: 2-(4-carbamoylthiazol-2-yl)pyrrolidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C16H16N4O5S MolecularWeight: 376.38704

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])C3=NC(=CS3)C(=O)N

Isomeric SMILES

C1CC(N(C1)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])C3=NC(=CS3)C(=O)N

InChI

InChI=1S/C16H16N4O5S/c17-14(21)12-9-26-15(18-12)13-2-1-7-19(13)16(22)25-8-10-3-5-11(6-4-10)20(23)24/h3-6,9,13H,1-2,7-8H2,(H2,17,21)