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

Systemtic Name: (1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)methyl-(furan-2-ylmethyl)-(pyridin-3-ylmethyl)azanium Openeye Name: (1,3-dimethyl-2-oxo-benzimidazol-5-yl)methyl-(2-furylmethyl)-(3-pyridylmethyl)ammonium CAS Name: (1,3-dimethyl-2-oxo-5-benzimidazolyl)methyl-(2-furanylmethyl)-(3-pyridinylmethyl)ammonium IUPAC Name: (1,3-dimethyl-2-oxobenzimidazol-5-yl)methyl-(furan-2-ylmethyl)-(pyridin-3-ylmethyl)azanium Traditional Name: 2-furfuryl-[(2-keto-1,3-dimethyl-benzimidazol-5-yl)methyl]-(3-pyridylmethyl)ammonium Formula: C21H23N4O2+ MolecularWeight: 363.43292

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C[NH+](CC3=CN=CC=C3)CC4=CC=CO4)N(C1=O)C

Isomeric SMILES

CN1C2=C(C=C(C=C2)C[NH+](CC3=CN=CC=C3)CC4=CC=CO4)N(C1=O)C

InChI

InChI=1S/C21H22N4O2/c1-23-19-8-7-16(11-20(19)24(2)21(23)26)13-25(15-18-6-4-10-27-18)14-17-5-3-9-22-12-17/h3-12H,13-15H2,1-2H3/p+1