2-[6-chloranyl-2-[[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]methyl]benzimidazol-1-yl]ethanol

Systemtic Name: 2-[6-chloranyl-2-[[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]methyl]benzimidazol-1-yl]ethanol Openeye Name: 2-[6-chloro-2-[[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]methyl]benzimidazol-1-yl]ethanol CAS Name: 2-[6-chloro-2-[[4-(2,3-dimethylphenyl)-1-piperazin-1-iumyl]methyl]-1-benzimidazolyl]ethanol IUPAC Name: 2-[6-chloro-2-[[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]methyl]benzimidazol-1-yl]ethanol Traditional Name: 2-[6-chloro-2-[[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]methyl]benzimidazol-1-yl]ethanol Formula: C22H28ClN4O+ MolecularWeight: 399.93692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CC[NH+](CC2)CC3=NC4=C(N3CCO)C=C(C=C4)Cl)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CC[NH+](CC2)CC3=NC4=C(N3CCO)C=C(C=C4)Cl)C

InChI

InChI=1S/C22H27ClN4O/c1-16-4-3-5-20(17(16)2)26-10-8-25(9-11-26)15-22-24-19-7-6-18(23)14-21(19)27(22)12-13-28/h3-7,14,28H,8-13,15H2,1-2H3/p+1