diethyl-[2-[2-(furan-2-ylmethylamino)-3H-benzimidazol-1-ium-1-yl]ethyl]azanium dichloride

Systemtic Name: diethyl-[2-[2-(furan-2-ylmethylamino)-3H-benzimidazol-1-ium-1-yl]ethyl]azanium dichloride Openeye Name: diethyl-[2-[2-(2-furylmethylamino)-3H-benzimidazol-1-ium-1-yl]ethyl]ammonium dichloride CAS Name: diethyl-[2-[2-(2-furanylmethylamino)-3H-benzimidazol-1-ium-1-yl]ethyl]ammonium dichloride IUPAC Name: diethyl-[2-[2-(furan-2-ylmethylamino)-3H-benzimidazol-1-ium-1-yl]ethyl]azanium dichloride Traditional Name: diethyl-[2-[2-(2-furfurylamino)-3H-benzimidazol-1-ium-1-yl]ethyl]ammonium dichloride Formula: C18H26Cl2N4O MolecularWeight: 385.33124

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC[N+]1=C(NC2=CC=CC=C21)NCC3=CC=CO3.[Cl-].[Cl-]

Isomeric SMILES

CC[NH+](CC)CC[N+]1=C(NC2=CC=CC=C21)NCC3=CC=CO3.[Cl-].[Cl-]

InChI

InChI=1S/C18H24N4O.2ClH/c1-3-21(4-2)11-12-22-17-10-6-5-9-16(17)20-18(22)19-14-15-8-7-13-23-15;;/h5-10,13H,3-4,11-12,14H2,1-2H3,(H,19,20);2*1H