4-chloranyl-3-nitro-N-(pyridin-1-ium-4-ylmethyl)-1H-pyrazole-5-carboxamide

Systemtic Name: 4-chloranyl-3-nitro-N-(pyridin-1-ium-4-ylmethyl)-1H-pyrazole-5-carboxamide Openeye Name: 4-chloro-3-nitro-N-(pyridin-1-ium-4-ylmethyl)-1H-pyrazole-5-carboxamide CAS Name: 4-chloro-3-nitro-N-(4-pyridin-1-iumylmethyl)-1H-pyrazole-5-carboxamide IUPAC Name: 4-chloro-3-nitro-N-(pyridin-1-ium-4-ylmethyl)-1H-pyrazole-5-carboxamide Traditional Name: 4-chloro-3-nitro-N-(pyridin-1-ium-4-ylmethyl)-1H-pyrazole-5-carboxamide Formula: C10H9ClN5O3+ MolecularWeight: 282.66316

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Descriptors Computed from Structure

Canonical SMILES:

C1=C[NH+]=CC=C1CNC(=O)C2=C(C(=NN2)[N+](=O)[O-])Cl

Isomeric SMILES

C1=C[NH+]=CC=C1CNC(=O)C2=C(C(=NN2)[N+](=O)[O-])Cl

InChI

InChI=1S/C10H8ClN5O3/c11-7-8(14-15-9(7)16(18)19)10(17)13-5-6-1-3-12-4-2-6/h1-4H,5H2,(H,13,17)(H,14,15)/p+1