N-cyclopentyl-4-methyl-N-[[1-[2-(2-methylphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-2-oxidanylidene-pentanamide

Systemtic Name: N-cyclopentyl-4-methyl-N-[[1-[2-(2-methylphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-2-oxidanylidene-pentanamide Openeye Name: N-cyclopentyl-4-methyl-N-[[1-[2-(o-tolyl)ethyl]piperidin-1-ium-4-yl]methyl]-2-oxo-pentanamide CAS Name: N-cyclopentyl-4-methyl-N-[[1-[2-(2-methylphenyl)ethyl]-4-piperidin-1-iumyl]methyl]-2-oxopentanamide IUPAC Name: N-cyclopentyl-4-methyl-N-[[1-[2-(2-methylphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-2-oxopentanamide Traditional Name: N-cyclopentyl-2-keto-4-methyl-N-[[1-[2-(o-tolyl)ethyl]piperidin-1-ium-4-yl]methyl]valeramide Formula: C26H41N2O2+ MolecularWeight: 413.61594

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H40N2O2/c1-20(2)18-25(29)26(30)28(24-10-6-7-11-24)19-22-12-15-27(16-13-22)17-14-23-9-5-4-8-21(23)3/h4-5,8-9,20,22,24H,6-7,10-19H2,1-3H3/p+1