N-[(E)-(1-methylpyrrol-2-yl)methylideneamino]-2-pyridin-1-ium-1-yl-ethanamide chloride

Systemtic Name: N-[(E)-(1-methylpyrrol-2-yl)methylideneamino]-2-pyridin-1-ium-1-yl-ethanamide chloride Openeye Name: N-[(E)-(1-methylpyrrol-2-yl)methyleneamino]-2-pyridin-1-ium-1-yl-acetamide chloride CAS Name: N-[(E)-(1-methyl-2-pyrrolyl)methylideneamino]-2-(1-pyridin-1-iumyl)acetamide chloride IUPAC Name: N-[(E)-(1-methylpyrrol-2-yl)methylideneamino]-2-pyridin-1-ium-1-ylacetamide chloride Traditional Name: N-[(E)-(1-methylpyrrol-2-yl)methyleneamino]-2-pyridin-1-ium-1-yl-acetamide chloride Formula: C13H15ClN4O MolecularWeight: 278.7374

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C=NNC(=O)C[N+]2=CC=CC=C2.[Cl-]

Isomeric SMILES

CN1C=CC=C1/C=N/NC(=O)C[N+]2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C13H14N4O.ClH/c1-16-7-5-6-12(16)10-14-15-13(18)11-17-8-3-2-4-9-17;/h2-10H,11H2,1H3;1H/b14-10+;