N-[[4-(diethylamino)phenyl]methyl]-1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-amine

Systemtic Name: N-[[4-(diethylamino)phenyl]methyl]-1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-amine Openeye Name: N-[[4-(diethylamino)phenyl]methyl]-1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-amine CAS Name: N-[[4-(diethylamino)phenyl]methyl]-1-[2-(1-piperidin-1-iumyl)ethyl]-2-benzimidazolamine IUPAC Name: N-[[4-(diethylamino)phenyl]methyl]-1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-amine Traditional Name: diethyl-[4-[[[1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-yl]amino]methyl]phenyl]amine Formula: C25H36N5+ MolecularWeight: 406.58684

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)CNC2=NC3=CC=CC=C3N2CC[NH+]4CCCCC4

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)CNC2=NC3=CC=CC=C3N2CC[NH+]4CCCCC4

InChI

InChI=1S/C25H35N5/c1-3-29(4-2)22-14-12-21(13-15-22)20-26-25-27-23-10-6-7-11-24(23)30(25)19-18-28-16-8-5-9-17-28/h6-7,10-15H,3-5,8-9,16-20H2,1-2H3,(H,26,27)/p+1