N-(5-methylpyridin-1-ium-2-yl)-2-nitro-benzamide

Systemtic Name: N-(5-methylpyridin-1-ium-2-yl)-2-nitro-benzamide Openeye Name: N-(5-methylpyridin-1-ium-2-yl)-2-nitro-benzamide CAS Name: N-(5-methyl-2-pyridin-1-iumyl)-2-nitrobenzamide IUPAC Name: N-(5-methylpyridin-1-ium-2-yl)-2-nitrobenzamide Traditional Name: N-(5-methylpyridin-1-ium-2-yl)-2-nitro-benzamide Formula: C13H12N3O3+ MolecularWeight: 258.25268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[NH+]=C(C=C1)NC(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC1=C[NH+]=C(C=C1)NC(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C13H11N3O3/c1-9-6-7-12(14-8-9)15-13(17)10-4-2-3-5-11(10)16(18)19/h2-8H,1H3,(H,14,15,17)/p+1