(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)methyl-(pyridin-3-ylmethyl)azanium chloride

Systemtic Name: (1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)methyl-(pyridin-3-ylmethyl)azanium chloride Openeye Name: (1,3-dimethyl-2-oxo-benzimidazol-5-yl)methyl-(3-pyridylmethyl)ammonium chloride CAS Name: (1,3-dimethyl-2-oxo-5-benzimidazolyl)methyl-(3-pyridinylmethyl)ammonium chloride IUPAC Name: (1,3-dimethyl-2-oxobenzimidazol-5-yl)methyl-(pyridin-3-ylmethyl)azanium chloride Traditional Name: (2-keto-1,3-dimethyl-benzimidazol-5-yl)methyl-(3-pyridylmethyl)ammonium chloride Formula: C16H19ClN4O MolecularWeight: 318.80126

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C[NH2+]CC3=CN=CC=C3)N(C1=O)C.[Cl-]

Isomeric SMILES

CN1C2=C(C=C(C=C2)C[NH2+]CC3=CN=CC=C3)N(C1=O)C.[Cl-]

InChI

InChI=1S/C16H18N4O.ClH/c1-19-14-6-5-12(8-15(14)20(2)16(19)21)9-18-11-13-4-3-7-17-10-13;/h3-8,10,18H,9,11H2,1-2H3;1H