N-(2-methyl-5-nitro-phenyl)-2-(3-oxidanylpyridin-1-ium-1-yl)ethanamide

Systemtic Name: N-(2-methyl-5-nitro-phenyl)-2-(3-oxidanylpyridin-1-ium-1-yl)ethanamide Openeye Name: 2-(3-hydroxypyridin-1-ium-1-yl)-N-(2-methyl-5-nitro-phenyl)acetamide CAS Name: 2-(3-hydroxy-1-pyridin-1-iumyl)-N-(2-methyl-5-nitrophenyl)acetamide IUPAC Name: 2-(3-hydroxypyridin-1-ium-1-yl)-N-(2-methyl-5-nitrophenyl)acetamide Traditional Name: 2-(3-hydroxypyridin-1-ium-1-yl)-N-(2-methyl-5-nitro-phenyl)acetamide Formula: C14H14N3O4+ MolecularWeight: 288.27866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C[N+]2=CC=CC(=C2)O

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C[N+]2=CC=CC(=C2)O

InChI

InChI=1S/C14H13N3O4/c1-10-4-5-11(17(20)21)7-13(10)15-14(19)9-16-6-2-3-12(18)8-16/h2-8H,9H2,1H3,(H-,15,18,19)/p+1