4-methyl-N-[[1-[(2-methylphenyl)methyl]piperidin-1-ium-4-yl]methyl]-N-(pyridin-3-ylmethyl)benzamide

Systemtic Name: 4-methyl-N-[[1-[(2-methylphenyl)methyl]piperidin-1-ium-4-yl]methyl]-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 4-methyl-N-[[1-(o-tolylmethyl)piperidin-1-ium-4-yl]methyl]-N-(3-pyridylmethyl)benzamide CAS Name: 4-methyl-N-[[1-[(2-methylphenyl)methyl]-4-piperidin-1-iumyl]methyl]-N-(3-pyridinylmethyl)benzamide IUPAC Name: 4-methyl-N-[[1-[(2-methylphenyl)methyl]piperidin-1-ium-4-yl]methyl]-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 4-methyl-N-[[1-(2-methylbenzyl)piperidin-1-ium-4-yl]methyl]-N-(3-pyridylmethyl)benzamide Formula: C28H34N3O+ MolecularWeight: 428.58906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N(CC2CC[NH+](CC2)CC3=CC=CC=C3C)CC4=CN=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N(CC2CC[NH+](CC2)CC3=CC=CC=C3C)CC4=CN=CC=C4

InChI

InChI=1S/C28H33N3O/c1-22-9-11-26(12-10-22)28(32)31(20-25-7-5-15-29-18-25)19-24-13-16-30(17-14-24)21-27-8-4-3-6-23(27)2/h3-12,15,18,24H,13-14,16-17,19-21H2,1-2H3/p+1