2-(2-ethylbenzimidazol-1-yl)-1-[4-(phenylmethyl)piperazin-4-ium-1-yl]ethanone

Systemtic Name: 2-(2-ethylbenzimidazol-1-yl)-1-[4-(phenylmethyl)piperazin-4-ium-1-yl]ethanone Openeye Name: 1-(4-benzylpiperazin-4-ium-1-yl)-2-(2-ethylbenzimidazol-1-yl)ethanone CAS Name: 2-(2-ethyl-1-benzimidazolyl)-1-[4-(phenylmethyl)-1-piperazin-4-iumyl]ethanone IUPAC Name: 1-(4-benzylpiperazin-4-ium-1-yl)-2-(2-ethylbenzimidazol-1-yl)ethanone Traditional Name: 1-(4-benzylpiperazin-4-ium-1-yl)-2-(2-ethylbenzimidazol-1-yl)ethanone Formula: C22H27N4O+ MolecularWeight: 363.47598

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2N1CC(=O)N3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

CCC1=NC2=CC=CC=C2N1CC(=O)N3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C22H26N4O/c1-2-21-23-19-10-6-7-11-20(19)26(21)17-22(27)25-14-12-24(13-15-25)16-18-8-4-3-5-9-18/h3-11H,2,12-17H2,1H3/p+1