4-methyl-N-(3-oxidanylpyridin-1-ium-2-yl)-3-pyrrol-1-yl-benzamide

Systemtic Name: 4-methyl-N-(3-oxidanylpyridin-1-ium-2-yl)-3-pyrrol-1-yl-benzamide Openeye Name: N-(3-hydroxypyridin-1-ium-2-yl)-4-methyl-3-pyrrol-1-yl-benzamide CAS Name: N-(3-hydroxy-2-pyridin-1-iumyl)-4-methyl-3-(1-pyrrolyl)benzamide IUPAC Name: N-(3-hydroxypyridin-1-ium-2-yl)-4-methyl-3-pyrrol-1-ylbenzamide Traditional Name: N-(3-hydroxypyridin-1-ium-2-yl)-4-methyl-3-pyrrol-1-yl-benzamide Formula: C17H16N3O2+ MolecularWeight: 294.32784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=C(C=CC=[NH+]2)O)N3C=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=C(C=CC=[NH+]2)O)N3C=CC=C3

InChI

InChI=1S/C17H15N3O2/c1-12-6-7-13(11-14(12)20-9-2-3-10-20)17(22)19-16-15(21)5-4-8-18-16/h2-11,21H,1H3,(H,18,19,22)/p+1