1-[1-(2-methoxyethyl)piperidin-1-ium-4-yl]-N-[(2-methyl-1H-imidazol-3-ium-5-yl)methyl]-N-(pyridin-4-ylmethyl)methanamine

Systemtic Name: 1-[1-(2-methoxyethyl)piperidin-1-ium-4-yl]-N-[(2-methyl-1H-imidazol-3-ium-5-yl)methyl]-N-(pyridin-4-ylmethyl)methanamine Openeye Name: 1-[1-(2-methoxyethyl)piperidin-1-ium-4-yl]-N-[(2-methyl-1H-imidazol-3-ium-5-yl)methyl]-N-(4-pyridylmethyl)methanamine CAS Name: 1-[1-(2-methoxyethyl)-4-piperidin-1-iumyl]-N-[(2-methyl-1H-imidazol-3-ium-5-yl)methyl]-N-(pyridin-4-ylmethyl)methanamine IUPAC Name: 1-[1-(2-methoxyethyl)piperidin-1-ium-4-yl]-N-[(2-methyl-1H-imidazol-3-ium-5-yl)methyl]-N-(pyridin-4-ylmethyl)methanamine Traditional Name: [1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl-[(2-methyl-1H-imidazol-3-ium-5-yl)methyl]-(4-pyridylmethyl)amine Formula: C20H33N5O+2 MolecularWeight: 359.50892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[NH+]C=C(N1)CN(CC2CC[NH+](CC2)CCOC)CC3=CC=NC=C3

Isomeric SMILES

CC1=[NH+]C=C(N1)CN(CC2CC[NH+](CC2)CCOC)CC3=CC=NC=C3

InChI

InChI=1S/C20H31N5O/c1-17-22-13-20(23-17)16-25(14-18-3-7-21-8-4-18)15-19-5-9-24(10-6-19)11-12-26-2/h3-4,7-8,13,19H,5-6,9-12,14-16H2,1-2H3,(H,22,23)/p+2