1-[(5,6-dimethyl-1H-benzimidazol-2-yl)methyl]pyridin-1-ium-3-carboxamide

Systemtic Name: 1-[(5,6-dimethyl-1H-benzimidazol-2-yl)methyl]pyridin-1-ium-3-carboxamide Openeye Name: 1-[(5,6-dimethyl-1H-benzimidazol-2-yl)methyl]pyridin-1-ium-3-carboxamide CAS Name: 1-[(5,6-dimethyl-1H-benzimidazol-2-yl)methyl]-3-pyridin-1-iumcarboxamide IUPAC Name: 1-[(5,6-dimethyl-1H-benzimidazol-2-yl)methyl]pyridin-1-ium-3-carboxamide Traditional Name: 1-[(5,6-dimethyl-1H-benzimidazol-2-yl)methyl]pyridin-1-ium-3-carboxamide Formula: C16H17N4O+ MolecularWeight: 281.33238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N=C(N2)C[N+]3=CC=CC(=C3)C(=O)N

Isomeric SMILES

CC1=CC2=C(C=C1C)N=C(N2)C[N+]3=CC=CC(=C3)C(=O)N

InChI

InChI=1S/C16H16N4O/c1-10-6-13-14(7-11(10)2)19-15(18-13)9-20-5-3-4-12(8-20)16(17)21/h3-8H,9H2,1-2H3,(H2-,17,18,19,21)/p+1