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Details

Stereochemistry ACHIRAL
Molecular Formula C20H28NO.I
Molecular Weight 425.3469
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of EMETONIUM IODIDE

SMILES

[I-].CC[N+](C)(CC)CCOC(C1=CC=CC=C1)C2=CC=CC=C2

InChI

InChIKey=HKOZYKMXXBHEHT-UHFFFAOYSA-M
InChI=1S/C20H28NO.HI/c1-4-21(3,5-2)16-17-22-20(18-12-8-6-9-13-18)19-14-10-7-11-15-19;/h6-15,20H,4-5,16-17H2,1-3H3;1H/q+1;/p-1

HIDE SMILES / InChI
Molecular Formula C20H28NO
Molecular Weight 298.4424
Charge 1
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE
Molecular Formula HI
Molecular Weight 127.9124
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Unknown
139594
Substance Class Chemical
Created
by admin
on Sat Dec 16 01:49:49 GMT 2023
Edited
by admin
on Sat Dec 16 01:49:49 GMT 2023
Record UNII
CW3OT0Y51W
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
EMETONIUM IODIDE
WHO-DD  
Common Name English
Emetonium iodide [WHO-DD]
Common Name English
METROPIN
Common Name English
ETHYLBENZHYDRAMINE METHYL IODIDE [MI]
Common Name English
ESYNTIN
Brand Name English
ETHYLBENZHYDRAMINE METHYL IODIDE
MI  
Systematic Name English
(2-(DIPHENYLMETHOXY)ETHYL)DIETHYLMETHYLAMMONIUM IODIDE
Systematic Name English
AMMONIUM, DIETHYL(2-(DIPHENYLMETHOXY)ETHYL)METHYL-, IODIDE
Systematic Name English
(2-BENZHYDRYLOXYETHYL)DIETHYL-METHYLAMMONIUM IODIDE
Systematic Name English
Classification Tree Code System Code
WHO-ATC A03AB16
Created by admin on Sat Dec 16 01:49:49 GMT 2023 , Edited by admin on Sat Dec 16 01:49:49 GMT 2023
WHO-VATC QA03AB16
Created by admin on Sat Dec 16 01:49:49 GMT 2023 , Edited by admin on Sat Dec 16 01:49:49 GMT 2023
Code System Code Type Description
CAS
5982-52-5
Created by admin on Sat Dec 16 01:49:49 GMT 2023 , Edited by admin on Sat Dec 16 01:49:49 GMT 2023
PRIMARY
EVMPD
SUB13669MIG
Created by admin on Sat Dec 16 01:49:49 GMT 2023 , Edited by admin on Sat Dec 16 01:49:49 GMT 2023
PRIMARY
MERCK INDEX
m174
Created by admin on Sat Dec 16 01:49:49 GMT 2023 , Edited by admin on Sat Dec 16 01:49:49 GMT 2023
PRIMARY Merck Index
DRUG CENTRAL
4327
Created by admin on Sat Dec 16 01:49:49 GMT 2023 , Edited by admin on Sat Dec 16 01:49:49 GMT 2023
PRIMARY
ChEMBL
CHEMBL3707205
Created by admin on Sat Dec 16 01:49:49 GMT 2023 , Edited by admin on Sat Dec 16 01:49:49 GMT 2023
PRIMARY
EPA CompTox
DTXSID70975216
Created by admin on Sat Dec 16 01:49:49 GMT 2023 , Edited by admin on Sat Dec 16 01:49:49 GMT 2023
PRIMARY
PUBCHEM
80084
Created by admin on Sat Dec 16 01:49:49 GMT 2023 , Edited by admin on Sat Dec 16 01:49:49 GMT 2023
PRIMARY
ECHA (EC/EINECS)
227-792-2
Created by admin on Sat Dec 16 01:49:49 GMT 2023 , Edited by admin on Sat Dec 16 01:49:49 GMT 2023
PRIMARY
SMS_ID
100000079479
Created by admin on Sat Dec 16 01:49:49 GMT 2023 , Edited by admin on Sat Dec 16 01:49:49 GMT 2023
PRIMARY
DRUG BANK
DB13769
Created by admin on Sat Dec 16 01:49:49 GMT 2023 , Edited by admin on Sat Dec 16 01:49:49 GMT 2023
PRIMARY
FDA UNII
CW3OT0Y51W
Created by admin on Sat Dec 16 01:49:49 GMT 2023 , Edited by admin on Sat Dec 16 01:49:49 GMT 2023
PRIMARY
Related Record Type Details
Structure of EMETONIUM
PARENT -> SALT/SOLVATE
Related Record Type Details
Structure of EMETONIUM
ACTIVE MOIETY
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