3-acetamido-N-cyclopentyl-N-[[1-[2-(2-methylphenyl)ethyl]piperidin-1-ium-4-yl]methyl]propanamide

Systemtic Name: 3-acetamido-N-cyclopentyl-N-[[1-[2-(2-methylphenyl)ethyl]piperidin-1-ium-4-yl]methyl]propanamide Openeye Name: 3-acetamido-N-cyclopentyl-N-[[1-[2-(o-tolyl)ethyl]piperidin-1-ium-4-yl]methyl]propanamide CAS Name: 3-acetamido-N-cyclopentyl-N-[[1-[2-(2-methylphenyl)ethyl]-4-piperidin-1-iumyl]methyl]propanamide IUPAC Name: 3-acetamido-N-cyclopentyl-N-[[1-[2-(2-methylphenyl)ethyl]piperidin-1-ium-4-yl]methyl]propanamide Traditional Name: 3-acetamido-N-cyclopentyl-N-[[1-[2-(o-tolyl)ethyl]piperidin-1-ium-4-yl]methyl]propionamide Formula: C25H40N3O2+ MolecularWeight: 414.604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC[NH+]2CCC(CC2)CN(C3CCCC3)C(=O)CCNC(=O)C

Isomeric SMILES

CC1=CC=CC=C1CC[NH+]2CCC(CC2)CN(C3CCCC3)C(=O)CCNC(=O)C

InChI

InChI=1S/C25H39N3O2/c1-20-7-3-4-8-23(20)14-18-27-16-12-22(13-17-27)19-28(24-9-5-6-10-24)25(30)11-15-26-21(2)29/h3-4,7-8,22,24H,5-6,9-19H2,1-2H3,(H,26,29)/p+1