5-[(2-methoxy-4-nitro-phenyl)carbamoyl]-1-methyl-pyrazole-4-carboxylic acid

Systemtic Name: 5-[(2-methoxy-4-nitro-phenyl)carbamoyl]-1-methyl-pyrazole-4-carboxylic acid Openeye Name: 5-[(2-methoxy-4-nitro-phenyl)carbamoyl]-1-methyl-pyrazole-4-carboxylic acid CAS Name: 5-[(2-methoxy-4-nitroanilino)-oxomethyl]-1-methyl-4-pyrazolecarboxylic acid IUPAC Name: 5-[(2-methoxy-4-nitrophenyl)carbamoyl]-1-methylpyrazole-4-carboxylic acid Traditional Name: 5-[(2-methoxy-4-nitro-phenyl)carbamoyl]-1-methyl-pyrazole-4-carboxylic acid Formula: C13H12N4O6 MolecularWeight: 320.25758

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)C(=O)O)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])OC

Isomeric SMILES

CN1C(=C(C=N1)C(=O)O)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C13H12N4O6/c1-16-11(8(6-14-16)13(19)20)12(18)15-9-4-3-7(17(21)22)5-10(9)23-2/h3-6H,1-2H3,(H,15,18)(H,19,20)