N-(1,3-dioxolan-2-ylmethyl)-N-[(1-methylbenzimidazol-2-yl)methyl]-6-(1H-pyrazol-2-ium-2-yl)pyridine-3-carboxamide

Systemtic Name: N-(1,3-dioxolan-2-ylmethyl)-N-[(1-methylbenzimidazol-2-yl)methyl]-6-(1H-pyrazol-2-ium-2-yl)pyridine-3-carboxamide Openeye Name: N-(1,3-dioxolan-2-ylmethyl)-N-[(1-methylbenzimidazol-2-yl)methyl]-6-(1H-pyrazol-2-ium-2-yl)pyridine-3-carboxamide CAS Name: N-(1,3-dioxolan-2-ylmethyl)-N-[(1-methyl-2-benzimidazolyl)methyl]-6-(1H-pyrazol-2-ium-2-yl)-3-pyridinecarboxamide IUPAC Name: N-(1,3-dioxolan-2-ylmethyl)-N-[(1-methylbenzimidazol-2-yl)methyl]-6-(1H-pyrazol-2-ium-2-yl)pyridine-3-carboxamide Traditional Name: N-(1,3-dioxolan-2-ylmethyl)-N-[(1-methylbenzimidazol-2-yl)methyl]-6-(1H-pyrazol-2-ium-2-yl)nicotinamide Formula: C22H23N6O3+ MolecularWeight: 419.45642

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1CN(CC3OCCO3)C(=O)C4=CN=C(C=C4)[N+]5=CC=CN5

Isomeric SMILES

CN1C2=CC=CC=C2N=C1CN(CC3OCCO3)C(=O)C4=CN=C(C=C4)[N+]5=CC=CN5

InChI

InChI=1S/C22H22N6O3/c1-26-18-6-3-2-5-17(18)25-20(26)14-27(15-21-30-11-12-31-21)22(29)16-7-8-19(23-13-16)28-10-4-9-24-28/h2-10,13,21H,11-12,14-15H2,1H3/p+1