N-(5-bromanylpyridin-2-yl)-2-methyl-4-nitro-1H-pyrazol-2-ium-3-carboxamide

Systemtic Name: N-(5-bromanylpyridin-2-yl)-2-methyl-4-nitro-1H-pyrazol-2-ium-3-carboxamide Openeye Name: N-(5-bromo-2-pyridyl)-2-methyl-4-nitro-1H-pyrazol-2-ium-3-carboxamide CAS Name: N-(5-bromo-2-pyridinyl)-2-methyl-4-nitro-1H-pyrazol-2-ium-3-carboxamide IUPAC Name: N-(5-bromopyridin-2-yl)-2-methyl-4-nitro-1H-pyrazol-2-ium-3-carboxamide Traditional Name: N-(5-bromo-2-pyridyl)-2-methyl-4-nitro-1H-pyrazol-2-ium-3-carboxamide Formula: C10H9BrN5O3+ MolecularWeight: 327.11416

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C(=CN1)[N+](=O)[O-])C(=O)NC2=NC=C(C=C2)Br

Isomeric SMILES

C[N+]1=C(C(=CN1)[N+](=O)[O-])C(=O)NC2=NC=C(C=C2)Br

InChI

InChI=1S/C10H8BrN5O3/c1-15-9(7(5-13-15)16(18)19)10(17)14-8-3-2-6(11)4-12-8/h2-5H,1H3,(H,12,14,17)/p+1