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

Systemtic Name: 2-(4-methoxyphenoxy)-N-[1-methyl-2-[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]benzimidazol-5-yl]ethanamide Openeye Name: 2-(4-methoxyphenoxy)-N-[1-methyl-2-[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]benzimidazol-5-yl]acetamide CAS Name: 2-(4-methoxyphenoxy)-N-[1-methyl-2-[2-[4-(2-pyridin-1-iumyl)-1-piperazinyl]ethyl]-5-benzimidazolyl]acetamide IUPAC Name: 2-(4-methoxyphenoxy)-N-[1-methyl-2-[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]benzimidazol-5-yl]acetamide Traditional Name: 2-(4-methoxyphenoxy)-N-[1-methyl-2-[2-(4-pyridin-1-ium-2-ylpiperazino)ethyl]benzimidazol-5-yl]acetamide Formula: C28H33N6O3+ MolecularWeight: 501.60002

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H32N6O3/c1-32-25-11-6-21(30-28(35)20-37-23-9-7-22(36-2)8-10-23)19-24(25)31-27(32)12-14-33-15-17-34(18-16-33)26-5-3-4-13-29-26/h3-11,13,19H,12,14-18,20H2,1-2H3,(H,30,35)/p+1