1-[4-[4-[[2-(2-hydroxyethylamino)benzimidazol-1-yl]methyl]piperazin-4-ium-1-yl]phenyl]ethanone

Systemtic Name: 1-[4-[4-[[2-(2-hydroxyethylamino)benzimidazol-1-yl]methyl]piperazin-4-ium-1-yl]phenyl]ethanone Openeye Name: 1-[4-[4-[[2-(2-hydroxyethylamino)benzimidazol-1-yl]methyl]piperazin-4-ium-1-yl]phenyl]ethanone CAS Name: 1-[4-[4-[[2-(2-hydroxyethylamino)-1-benzimidazolyl]methyl]-1-piperazin-4-iumyl]phenyl]ethanone IUPAC Name: 1-[4-[4-[[2-(2-hydroxyethylamino)benzimidazol-1-yl]methyl]piperazin-4-ium-1-yl]phenyl]ethanone Traditional Name: 1-[4-[4-[[2-(2-hydroxyethylamino)benzimidazol-1-yl]methyl]piperazin-4-ium-1-yl]phenyl]ethanone Formula: C22H28N5O2+ MolecularWeight: 394.49002

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CC[NH+](CC2)CN3C4=CC=CC=C4N=C3NCCO

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CC[NH+](CC2)CN3C4=CC=CC=C4N=C3NCCO

InChI

InChI=1S/C22H27N5O2/c1-17(29)18-6-8-19(9-7-18)26-13-11-25(12-14-26)16-27-21-5-3-2-4-20(21)24-22(27)23-10-15-28/h2-9,28H,10-16H2,1H3,(H,23,24)/p+1