2-(3-methylphenoxy)-N-[1-methyl-2-[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]benzimidazol-5-yl]ethanamide

Systemtic Name: 2-(3-methylphenoxy)-N-[1-methyl-2-[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]benzimidazol-5-yl]ethanamide Openeye Name: 2-(3-methylphenoxy)-N-[1-methyl-2-[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]benzimidazol-5-yl]acetamide CAS Name: 2-(3-methylphenoxy)-N-[1-methyl-2-[2-[4-(2-pyridin-1-iumyl)-1-piperazinyl]ethyl]-5-benzimidazolyl]acetamide IUPAC Name: 2-(3-methylphenoxy)-N-[1-methyl-2-[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]benzimidazol-5-yl]acetamide Traditional Name: 2-(3-methylphenoxy)-N-[1-methyl-2-[2-(4-pyridin-1-ium-2-ylpiperazino)ethyl]benzimidazol-5-yl]acetamide Formula: C28H33N6O2+ MolecularWeight: 485.60062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(=O)NC2=CC3=C(C=C2)N(C(=N3)CCN4CCN(CC4)C5=CC=CC=[NH+]5)C

Isomeric SMILES

CC1=CC(=CC=C1)OCC(=O)NC2=CC3=C(C=C2)N(C(=N3)CCN4CCN(CC4)C5=CC=CC=[NH+]5)C

InChI

InChI=1S/C28H32N6O2/c1-21-6-5-7-23(18-21)36-20-28(35)30-22-9-10-25-24(19-22)31-27(32(25)2)11-13-33-14-16-34(17-15-33)26-8-3-4-12-29-26/h3-10,12,18-19H,11,13-17,20H2,1-2H3,(H,30,35)/p+1