2-[3,5-bis(bromanyl)-4-nitro-pyrazol-1-yl]ethanoic acid

Systemtic Name: 2-[3,5-bis(bromanyl)-4-nitro-pyrazol-1-yl]ethanoic acid Openeye Name: 2-(3,5-dibromo-4-nitro-pyrazol-1-yl)acetic acid CAS Name: 2-(3,5-dibromo-4-nitro-1-pyrazolyl)acetic acid IUPAC Name: 2-(3,5-dibromo-4-nitropyrazol-1-yl)acetic acid Traditional Name: 2-(3,5-dibromo-4-nitro-pyrazol-1-yl)acetic acid Formula: C5H3Br2N3O4 MolecularWeight: 328.90302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(C(=O)O)N1C(=C(C(=N1)Br)[N+](=O)[O-])Br

Isomeric SMILES

C(C(=O)O)N1C(=C(C(=N1)Br)[N+](=O)[O-])Br

InChI

InChI=1S/C5H3Br2N3O4/c6-4-3(10(13)14)5(7)9(8-4)1-2(11)12/h1H2,(H,11,12)