2-imidazol-1-yl-N-[[(3R)-1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N-methyl-ethanamide

Systemtic Name: 2-imidazol-1-yl-N-[[(3R)-1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N-methyl-ethanamide Openeye Name: 2-imidazol-1-yl-N-[[(3R)-1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N-methyl-acetamide CAS Name: 2-(1-imidazolyl)-N-[[(3R)-1-[2-(4-methoxyphenyl)ethyl]-3-piperidin-1-iumyl]methyl]-N-methylacetamide IUPAC Name: 2-imidazol-1-yl-N-[[(3R)-1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N-methylacetamide Traditional Name: 2-imidazol-1-yl-N-[[(3R)-1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N-methyl-acetamide Formula: C21H31N4O2+ MolecularWeight: 371.49644

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1CCC[NH+](C1)CCC2=CC=C(C=C2)OC)C(=O)CN3C=CN=C3

Isomeric SMILES

CN(C[C@H]1CCC[NH+](C1)CCC2=CC=C(C=C2)OC)C(=O)CN3C=CN=C3

InChI

InChI=1S/C21H30N4O2/c1-23(21(26)16-25-13-10-22-17-25)14-19-4-3-11-24(15-19)12-9-18-5-7-20(27-2)8-6-18/h5-8,10,13,17,19H,3-4,9,11-12,14-16H2,1-2H3/p+1/t19-/m1/s1