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

Systemtic Name: N-methyl-N-[[(3R)-1-[2-(2-methylphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-3-pyridin-4-yl-propanamide Openeye Name: N-methyl-N-[[(3R)-1-[2-(o-tolyl)ethyl]piperidin-1-ium-3-yl]methyl]-3-(4-pyridyl)propanamide CAS Name: N-methyl-N-[[(3R)-1-[2-(2-methylphenyl)ethyl]-3-piperidin-1-iumyl]methyl]-3-pyridin-4-ylpropanamide IUPAC Name: N-methyl-N-[[(3R)-1-[2-(2-methylphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-3-pyridin-4-ylpropanamide Traditional Name: N-methyl-N-[[(3R)-1-[2-(o-tolyl)ethyl]piperidin-1-ium-3-yl]methyl]-3-(4-pyridyl)propionamide Formula: C24H34N3O+ MolecularWeight: 380.54626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC[NH+]2CCCC(C2)CN(C)C(=O)CCC3=CC=NC=C3

Isomeric SMILES

CC1=CC=CC=C1CC[NH+]2CCC[C@@H](C2)CN(C)C(=O)CCC3=CC=NC=C3

InChI

InChI=1S/C24H33N3O/c1-20-6-3-4-8-23(20)13-17-27-16-5-7-22(19-27)18-26(2)24(28)10-9-21-11-14-25-15-12-21/h3-4,6,8,11-12,14-15,22H,5,7,9-10,13,16-19H2,1-2H3/p+1/t22-/m1/s1