3-azanyl-4-[(4-nitro-1H-pyrazol-5-yl)carbonylamino]benzoic acid

Systemtic Name: 3-azanyl-4-[(4-nitro-1H-pyrazol-5-yl)carbonylamino]benzoic acid Openeye Name: 3-amino-4-[(4-nitro-1H-pyrazole-5-carbonyl)amino]benzoic acid CAS Name: 3-amino-4-[[(4-nitro-1H-pyrazol-5-yl)-oxomethyl]amino]benzoic acid IUPAC Name: 3-amino-4-[(4-nitro-1H-pyrazole-5-carbonyl)amino]benzoic acid Traditional Name: 3-amino-4-[(4-nitro-1H-pyrazole-5-carbonyl)amino]benzoic acid Formula: C11H9N5O5 MolecularWeight: 291.21966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)O)N)NC(=O)C2=C(C=NN2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1C(=O)O)N)NC(=O)C2=C(C=NN2)[N+](=O)[O-]

InChI

InChI=1S/C11H9N5O5/c12-6-3-5(11(18)19)1-2-7(6)14-10(17)9-8(16(20)21)4-13-15-9/h1-4H,12H2,(H,13,15)(H,14,17)(H,18,19)