ISOMETHADONE HYDROBROMIDE

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NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C21H27NO.BrH
Molecular Weight	390.357
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ISOMETHADONE HYDROBROMIDE

Structure Search

SMILES

Br.CCC(=O)C(C(C)CN(C)C)(C1=CC=CC=C1)C2=CC=CC=C2

InChI

InChIKey=FDTSMJLKASTENG-UHFFFAOYSA-N

InChI=1S/C21H27NO.BrH/c1-5-20(23)21(17(2)16-22(3)4,18-12-8-6-9-13-18)19-14-10-7-11-15-19;/h6-15,17H,5,16H2,1-4H3;1H

HIDE SMILES / InChI

Description
Sources: https://www.drugfuture.com/chemdata/isomethadone.html | https://www.deadiversion.usdoj.gov/fed_regs/quotas/2014/fr0825.htm

ISOMETHADONE HYDROBROMIDE, DL- is a hydrobromide salt of isomethadone, a synthetic opioid analgesic. This is a controlled substance in the US.

Approval Year

PubMed

PubMed

Title	Date	PubMed
Stereochemical basis for a unified structure activity theory of aromatic and heterocyclic rings in selected opioids and opioid peptides.	2010 Feb 18	20212915

Patents

Patents

Name

Type

Language

ISOMETHADONE HYDROBROMIDE

Common Name

English

ISOMETHADONE HYDROBROMIDE, DL-

Common Name

English

ISOMETHADONE DL-FORM HYDROBROMIDE [MI]

Common Name

English

3-HEXANONE, 6-(DIMETHYLAMINO)-5-METHYL-4,4-DIPHENYL-, HYDROBROMIDE

Systematic Name

English

Code System Code Type Description

FDA UNII

W8PU00YDDB

Created by admin on Sat Dec 16 09:11:07 GMT 2023 , Edited by admin on Sat Dec 16 09:11:07 GMT 2023

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CAS

63765-85-5

Created by admin on Sat Dec 16 09:11:07 GMT 2023 , Edited by admin on Sat Dec 16 09:11:07 GMT 2023

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EPA CompTox

DTXSID10980304

Created by admin on Sat Dec 16 09:11:07 GMT 2023 , Edited by admin on Sat Dec 16 09:11:07 GMT 2023

PRIMARY

PUBCHEM

44683

Created by admin on Sat Dec 16 09:11:07 GMT 2023 , Edited by admin on Sat Dec 16 09:11:07 GMT 2023

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MERCK INDEX

m6500

Created by admin on Sat Dec 16 09:11:07 GMT 2023 , Edited by admin on Sat Dec 16 09:11:07 GMT 2023

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Merck Index

PARENT (SALT/SOLVATE)


					12L95QD6KV

SUBSTANCE RECORD


					W8PU00YDDB

ISOMETHADONE HYDROBROMIDE