3-[1-(1-methylpiperidin-1-ium-4-yl)piperidin-4-yl]oxy-N-(3-methylsulfanylpropyl)benzamide

Systemtic Name: 3-[1-(1-methylpiperidin-1-ium-4-yl)piperidin-4-yl]oxy-N-(3-methylsulfanylpropyl)benzamide Openeye Name: 3-[[1-(1-methylpiperidin-1-ium-4-yl)-4-piperidyl]oxy]-N-(3-methylsulfanylpropyl)benzamide CAS Name: 3-[[1-(1-methyl-4-piperidin-1-iumyl)-4-piperidinyl]oxy]-N-[3-(methylthio)propyl]benzamide IUPAC Name: 3-[1-(1-methylpiperidin-1-ium-4-yl)piperidin-4-yl]oxy-N-(3-methylsulfanylpropyl)benzamide Traditional Name: 3-[[1-(1-methylpiperidin-1-ium-4-yl)-4-piperidyl]oxy]-N-[3-(methylthio)propyl]benzamide Formula: C22H36N3O2S+ MolecularWeight: 406.60514

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)N2CCC(CC2)OC3=CC=CC(=C3)C(=O)NCCCSC

Isomeric SMILES

C[NH+]1CCC(CC1)N2CCC(CC2)OC3=CC=CC(=C3)C(=O)NCCCSC

InChI

InChI=1S/C22H35N3O2S/c1-24-12-7-19(8-13-24)25-14-9-20(10-15-25)27-21-6-3-5-18(17-21)22(26)23-11-4-16-28-2/h3,5-6,17,19-20H,4,7-16H2,1-2H3,(H,23,26)/p+1