N-[(2-methylphenyl)methyl]-3-[1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]oxy-benzamide

Systemtic Name: N-[(2-methylphenyl)methyl]-3-[1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]oxy-benzamide Openeye Name: 3-[1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]oxy-N-(o-tolylmethyl)benzamide CAS Name: N-[(2-methylphenyl)methyl]-3-[[1-(1-methyl-4-piperidin-1-iumyl)-4-piperidin-1-iumyl]oxy]benzamide IUPAC Name: N-[(2-methylphenyl)methyl]-3-[1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]oxybenzamide Traditional Name: N-(2-methylbenzyl)-3-[1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]oxy-benzamide Formula: C26H37N3O2+2 MolecularWeight: 423.59088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC(=O)C2=CC(=CC=C2)OC3CC[NH+](CC3)C4CC[NH+](CC4)C

Isomeric SMILES

CC1=CC=CC=C1CNC(=O)C2=CC(=CC=C2)OC3CC[NH+](CC3)C4CC[NH+](CC4)C

InChI

InChI=1S/C26H35N3O2/c1-20-6-3-4-7-22(20)19-27-26(30)21-8-5-9-25(18-21)31-24-12-16-29(17-13-24)23-10-14-28(2)15-11-23/h3-9,18,23-24H,10-17,19H2,1-2H3,(H,27,30)/p+2