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

Systemtic Name: N-(1H-imidazol-3-ium-2-ylmethyl)-1-[(3R)-1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]-N-methyl-methanamine Openeye Name: N-(1H-imidazol-3-ium-2-ylmethyl)-1-[(3R)-1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]-N-methyl-methanamine CAS Name: N-(1H-imidazol-3-ium-2-ylmethyl)-1-[(3R)-1-[2-(4-methoxyphenyl)ethyl]-3-piperidin-1-iumyl]-N-methylmethanamine IUPAC Name: N-(1H-imidazol-3-ium-2-ylmethyl)-1-[(3R)-1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]-N-methylmethanamine Traditional Name: 1H-imidazol-3-ium-2-ylmethyl-[[(3R)-1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-methyl-amine Formula: C20H32N4O+2 MolecularWeight: 344.49428

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1CCC[NH+](C1)CCC2=CC=C(C=C2)OC)CC3=[NH+]C=CN3

Isomeric SMILES

CN(C[C@H]1CCC[NH+](C1)CCC2=CC=C(C=C2)OC)CC3=[NH+]C=CN3

InChI

InChI=1S/C20H30N4O/c1-23(16-20-21-10-11-22-20)14-18-4-3-12-24(15-18)13-9-17-5-7-19(25-2)8-6-17/h5-8,10-11,18H,3-4,9,12-16H2,1-2H3,(H,21,22)/p+2/t18-/m1/s1