2-(4-chloranylphenoxy)-N-[1-methyl-2-[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]benzimidazol-5-yl]ethanamide

Systemtic Name: 2-(4-chloranylphenoxy)-N-[1-methyl-2-[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]benzimidazol-5-yl]ethanamide Openeye Name: 2-(4-chlorophenoxy)-N-[1-methyl-2-[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]benzimidazol-5-yl]acetamide CAS Name: 2-(4-chlorophenoxy)-N-[1-methyl-2-[2-[4-(2-pyridin-1-iumyl)-1-piperazinyl]ethyl]-5-benzimidazolyl]acetamide IUPAC Name: 2-(4-chlorophenoxy)-N-[1-methyl-2-[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]benzimidazol-5-yl]acetamide Traditional Name: 2-(4-chlorophenoxy)-N-[1-methyl-2-[2-(4-pyridin-1-ium-2-ylpiperazino)ethyl]benzimidazol-5-yl]acetamide Formula: C27H30ClN6O2+ MolecularWeight: 506.0191

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)NC(=O)COC3=CC=C(C=C3)Cl)N=C1CCN4CCN(CC4)C5=CC=CC=[NH+]5

Isomeric SMILES

CN1C2=C(C=C(C=C2)NC(=O)COC3=CC=C(C=C3)Cl)N=C1CCN4CCN(CC4)C5=CC=CC=[NH+]5

InChI

InChI=1S/C27H29ClN6O2/c1-32-24-10-7-21(30-27(35)19-36-22-8-5-20(28)6-9-22)18-23(24)31-26(32)11-13-33-14-16-34(17-15-33)25-4-2-3-12-29-25/h2-10,12,18H,11,13-17,19H2,1H3,(H,30,35)/p+1