N-methyl-N-[[(3R)-1-[2-(2-methylphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-2-thiophen-3-yl-ethanamide

Systemtic Name: N-methyl-N-[[(3R)-1-[2-(2-methylphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-2-thiophen-3-yl-ethanamide Openeye Name: N-methyl-N-[[(3R)-1-[2-(o-tolyl)ethyl]piperidin-1-ium-3-yl]methyl]-2-(3-thienyl)acetamide CAS Name: N-methyl-N-[[(3R)-1-[2-(2-methylphenyl)ethyl]-3-piperidin-1-iumyl]methyl]-2-(3-thiophenyl)acetamide IUPAC Name: N-methyl-N-[[(3R)-1-[2-(2-methylphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-2-thiophen-3-ylacetamide Traditional Name: N-methyl-N-[[(3R)-1-[2-(o-tolyl)ethyl]piperidin-1-ium-3-yl]methyl]-2-(3-thienyl)acetamide Formula: C22H31N2OS+ MolecularWeight: 371.55934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC[NH+]2CCCC(C2)CN(C)C(=O)CC3=CSC=C3

Isomeric SMILES

CC1=CC=CC=C1CC[NH+]2CCC[C@@H](C2)CN(C)C(=O)CC3=CSC=C3

InChI

InChI=1S/C22H30N2OS/c1-18-6-3-4-8-21(18)9-12-24-11-5-7-20(16-24)15-23(2)22(25)14-19-10-13-26-17-19/h3-4,6,8,10,13,17,20H,5,7,9,11-12,14-16H2,1-2H3/p+1/t20-/m1/s1