1-[2-(Dibenzylamino)ethyl]-1-methylpiperidin-1-ium bromide (Q82873922)

chemical compound

Language	Label	Description	Also known as
English	1-[2-(Dibenzylamino)ethyl]-1-methylpiperidin-1-ium bromide	chemical compound

Statements

instance of

type of chemical entity

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subclass of

chemical compound

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mass

402.16706109200004 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₂H₃₁BrN₂

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

C[N+]1(CCN(Cc2ccccc2)Cc2ccccc2)CCCCC1.[Br-]

1 reference

based on heuristic

inferred from InChI

Identifiers

InChI

InChI=1S/C22H31N2.BrH/c1-24(16-9-4-10-17-24)18-15-23(19-21-11-5-2-6-12-21)20-22-13-7-3-8-14-22;/h2-3,5-8,11-14H,4,9-10,15-20H2,1H3;1H/q+1;/p-1

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InChIKey

DFQKEVPLRMTOTJ-UHFFFAOYSA-M

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1 reference

26 December 2021

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DSSTOX compound identifier

DTXCID801334539

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1-[2-(Dibenzylamino)ethyl]-1-methylpiperidin-1-ium bromide (Q82873922)

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1-[2-(Dibenzylamino)ethyl]-1-methylpiperidin-1-ium bromide (Q82873922)

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