4-chloranyl-1-methyl-5-nitro-pyrazole-3-carboxylic acid

Systemtic Name: 4-chloranyl-1-methyl-5-nitro-pyrazole-3-carboxylic acid Openeye Name: 4-chloro-1-methyl-5-nitro-pyrazole-3-carboxylic acid CAS Name: 4-chloro-1-methyl-5-nitro-3-pyrazolecarboxylic acid IUPAC Name: 4-chloro-1-methyl-5-nitropyrazole-3-carboxylic acid Traditional Name: 4-chloro-1-methyl-5-nitro-pyrazole-3-carboxylic acid Formula: C5H4ClN3O4 MolecularWeight: 205.55596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)C(=O)O)Cl)[N+](=O)[O-]

Isomeric SMILES

CN1C(=C(C(=N1)C(=O)O)Cl)[N+](=O)[O-]

InChI

InChI=1S/C5H4ClN3O4/c1-8-4(9(12)13)2(6)3(7-8)5(10)11/h1H3,(H,10,11)