4-[(2-methyl-4-nitro-pyrazol-3-yl)carbonylamino]benzoic acid

Systemtic Name: 4-[(2-methyl-4-nitro-pyrazol-3-yl)carbonylamino]benzoic acid Openeye Name: 4-[(2-methyl-4-nitro-pyrazole-3-carbonyl)amino]benzoic acid CAS Name: 4-[[(2-methyl-4-nitro-3-pyrazolyl)-oxomethyl]amino]benzoic acid IUPAC Name: 4-[(2-methyl-4-nitropyrazole-3-carbonyl)amino]benzoic acid Traditional Name: 4-[(2-methyl-4-nitro-pyrazole-3-carbonyl)amino]benzoic acid Formula: C12H10N4O5 MolecularWeight: 290.2316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H10N4O5/c1-15-10(9(6-13-15)16(20)21)11(17)14-8-4-2-7(3-5-8)12(18)19/h2-6H,1H3,(H,14,17)(H,18,19)