N-(4-bromanyl-3-methyl-phenyl)-2-(3-oxidanylpyridin-1-ium-1-yl)ethanamide chloride

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-2-(3-oxidanylpyridin-1-ium-1-yl)ethanamide chloride Openeye Name: N-(4-bromo-3-methyl-phenyl)-2-(3-hydroxypyridin-1-ium-1-yl)acetamide chloride CAS Name: N-(4-bromo-3-methylphenyl)-2-(3-hydroxy-1-pyridin-1-iumyl)acetamide chloride IUPAC Name: N-(4-bromo-3-methylphenyl)-2-(3-hydroxypyridin-1-ium-1-yl)acetamide chloride Traditional Name: N-(4-bromo-3-methyl-phenyl)-2-(3-hydroxypyridin-1-ium-1-yl)acetamide chloride Formula: C14H14BrClN2O2 MolecularWeight: 357.63016

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13BrN2O2.ClH/c1-10-7-11(4-5-13(10)15)16-14(19)9-17-6-2-3-12(18)8-17;/h2-8H,9H2,1H3,(H-,16,18,19);1H