[1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl-[(2-methylphenyl)methyl]-(pyridin-4-ylmethyl)azanium

Systemtic Name: [1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl-[(2-methylphenyl)methyl]-(pyridin-4-ylmethyl)azanium Openeye Name: [1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl-(o-tolylmethyl)-(4-pyridylmethyl)ammonium CAS Name: [1-(2-methoxyethyl)-4-piperidin-1-iumyl]methyl-[(2-methylphenyl)methyl]-(pyridin-4-ylmethyl)ammonium IUPAC Name: [1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl-[(2-methylphenyl)methyl]-(pyridin-4-ylmethyl)azanium Traditional Name: [1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl-(2-methylbenzyl)-(4-pyridylmethyl)ammonium Formula: C23H35N3O+2 MolecularWeight: 369.5435

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+](CC2CC[NH+](CC2)CCOC)CC3=CC=NC=C3

Isomeric SMILES

CC1=CC=CC=C1C[NH+](CC2CC[NH+](CC2)CCOC)CC3=CC=NC=C3

InChI

InChI=1S/C23H33N3O/c1-20-5-3-4-6-23(20)19-26(17-21-7-11-24-12-8-21)18-22-9-13-25(14-10-22)15-16-27-2/h3-8,11-12,22H,9-10,13-19H2,1-2H3/p+2