N-ethyl-N-methyl-1-[1-[(2-methylphenyl)methyl]piperidin-1-ium-4-yl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-ethyl-N-methyl-1-[1-[(2-methylphenyl)methyl]piperidin-1-ium-4-yl]piperidin-1-ium-4-carboxamide Openeye Name: N-ethyl-N-methyl-1-[1-(o-tolylmethyl)piperidin-1-ium-4-yl]piperidin-1-ium-4-carboxamide CAS Name: N-ethyl-N-methyl-1-[1-[(2-methylphenyl)methyl]-4-piperidin-1-iumyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-ethyl-N-methyl-1-[1-[(2-methylphenyl)methyl]piperidin-1-ium-4-yl]piperidin-1-ium-4-carboxamide Traditional Name: N-ethyl-N-methyl-1-[1-(2-methylbenzyl)piperidin-1-ium-4-yl]piperidin-1-ium-4-carboxamide Formula: C22H37N3O+2 MolecularWeight: 359.54868

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C)C(=O)C1CC[NH+](CC1)C2CC[NH+](CC2)CC3=CC=CC=C3C

Isomeric SMILES

CCN(C)C(=O)C1CC[NH+](CC1)C2CC[NH+](CC2)CC3=CC=CC=C3C

InChI

InChI=1S/C22H35N3O/c1-4-23(3)22(26)19-9-15-25(16-10-19)21-11-13-24(14-12-21)17-20-8-6-5-7-18(20)2/h5-8,19,21H,4,9-17H2,1-3H3/p+2