[2-(benzimidazol-1-yl)pyridin-3-yl]methyl-(1,3-benzodioxol-4-ylmethyl)azanium

Systemtic Name: [2-(benzimidazol-1-yl)pyridin-3-yl]methyl-(1,3-benzodioxol-4-ylmethyl)azanium Openeye Name: [2-(benzimidazol-1-yl)-3-pyridyl]methyl-(1,3-benzodioxol-4-ylmethyl)ammonium CAS Name: [2-(1-benzimidazolyl)-3-pyridinyl]methyl-(1,3-benzodioxol-4-ylmethyl)ammonium IUPAC Name: [2-(benzimidazol-1-yl)pyridin-3-yl]methyl-(1,3-benzodioxol-4-ylmethyl)azanium Traditional Name: [2-(benzimidazol-1-yl)-3-pyridyl]methyl-(1,3-benzodioxol-4-ylmethyl)ammonium Formula: C21H19N4O2+ MolecularWeight: 359.40116

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=CC=CC(=C2O1)C[NH2+]CC3=C(N=CC=C3)N4C=NC5=CC=CC=C54

Isomeric SMILES

C1OC2=CC=CC(=C2O1)C[NH2+]CC3=C(N=CC=C3)N4C=NC5=CC=CC=C54

InChI

InChI=1S/C21H18N4O2/c1-2-8-18-17(7-1)24-13-25(18)21-16(6-4-10-23-21)12-22-11-15-5-3-9-19-20(15)27-14-26-19/h1-10,13,22H,11-12,14H2/p+1