(4-aminocarbonyl-2-nitro-phenyl)methyl 2-acetamido-1,3-thiazole-4-carboxylate

Systemtic Name: (4-aminocarbonyl-2-nitro-phenyl)methyl 2-acetamido-1,3-thiazole-4-carboxylate Openeye Name: (4-carbamoyl-2-nitro-phenyl)methyl 2-acetamidothiazole-4-carboxylate CAS Name: 2-acetamido-4-thiazolecarboxylic acid (4-carbamoyl-2-nitrophenyl)methyl ester IUPAC Name: (4-carbamoyl-2-nitrophenyl)methyl 2-acetamido-1,3-thiazole-4-carboxylate Traditional Name: 2-acetamidothiazole-4-carboxylic acid (4-carbamoyl-2-nitro-benzyl) ester Formula: C14H12N4O6S MolecularWeight: 364.33328

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=CS1)C(=O)OCC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=NC(=CS1)C(=O)OCC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C14H12N4O6S/c1-7(19)16-14-17-10(6-25-14)13(21)24-5-9-3-2-8(12(15)20)4-11(9)18(22)23/h2-4,6H,5H2,1H3,(H2,15,20)(H,16,17,19)