N-[[1-[(2-methoxyphenyl)methyl]piperidin-1-ium-4-yl]methyl]-2-methyl-N-[(5-methyl-1H-imidazol-3-ium-2-yl)methyl]propan-1-amine

Systemtic Name: N-[[1-[(2-methoxyphenyl)methyl]piperidin-1-ium-4-yl]methyl]-2-methyl-N-[(5-methyl-1H-imidazol-3-ium-2-yl)methyl]propan-1-amine Openeye Name: N-[[1-[(2-methoxyphenyl)methyl]piperidin-1-ium-4-yl]methyl]-2-methyl-N-[(5-methyl-1H-imidazol-3-ium-2-yl)methyl]propan-1-amine CAS Name: N-[[1-[(2-methoxyphenyl)methyl]-4-piperidin-1-iumyl]methyl]-2-methyl-N-[(5-methyl-1H-imidazol-3-ium-2-yl)methyl]-1-propanamine IUPAC Name: N-[[1-[(2-methoxyphenyl)methyl]piperidin-1-ium-4-yl]methyl]-2-methyl-N-[(5-methyl-1H-imidazol-3-ium-2-yl)methyl]propan-1-amine Traditional Name: isobutyl-[(5-methyl-1H-imidazol-3-ium-2-yl)methyl]-[(1-o-anisylpiperidin-1-ium-4-yl)methyl]amine Formula: C23H38N4O+2 MolecularWeight: 386.57402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[NH+]=C(N1)CN(CC2CC[NH+](CC2)CC3=CC=CC=C3OC)CC(C)C

Isomeric SMILES

CC1=C[NH+]=C(N1)CN(CC2CC[NH+](CC2)CC3=CC=CC=C3OC)CC(C)C

InChI

InChI=1S/C23H36N4O/c1-18(2)14-27(17-23-24-13-19(3)25-23)15-20-9-11-26(12-10-20)16-21-7-5-6-8-22(21)28-4/h5-8,13,18,20H,9-12,14-17H2,1-4H3,(H,24,25)/p+2