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Details

Stereochemistry RACEMIC
Molecular Formula C7H16NO2.I
Molecular Weight 273.1119
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of OXAPROPANIUM IODIDE

SMILES

[I-].C[N+](C)(C)CC1COCO1

InChI

InChIKey=HQWAEQCLIWVOMF-UHFFFAOYSA-M
InChI=1S/C7H16NO2.HI/c1-8(2,3)4-7-5-9-6-10-7;/h7H,4-6H2,1-3H3;1H/q+1;/p-1

HIDE SMILES / InChI
Molecular Formula C7H16NO2
Molecular Weight 146.2074
Charge 1
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )
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

Description

Oxapropanium was studied as a cholinergic agent. Information about the current use of this compound is not available.

Approval Year

Unknown
139594
Substance Class Chemical
Created
by admin
on Fri Dec 15 17:07:19 UTC 2023
Edited
by admin
on Fri Dec 15 17:07:19 UTC 2023
Record UNII
3F725G9N2A
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
OXAPROPANIUM IODIDE
INN   MI  
INN  
Official Name English
(1,3-DIOXOLAN-4-YLMETHYL)TRIMETHYLAMMONIUM IODIDE
Systematic Name English
N,N,N-TRIMETHYL-1,3-DIOXOLANE-4-METHANAMINIUM IODIDE (1:1)
Systematic Name English
DILVASENE
Brand Name English
oxapropanium iodide [INN]
Common Name English
2249-F
Code English
AMMONIUM, (1,3-DIOXOLAN-4-YLMETHYL)TRIMETHYL-, IODIDE
Systematic Name English
OXAPROPANIUM IODIDE [MI]
Common Name English
1,3-DIOXOLANE-4-METHANAMINIUM, N,N,N-TRIMETHYL-, IODIDE (1:1)
Systematic Name English
TRIMETHYL(2,3-METHYLENEDIOXYPROPYL)AMMONIUM IODIDE
Systematic Name English
VASODILATATEUR-2249F
Code English
Classification Tree Code System Code
NCI_THESAURUS C66886
Created by admin on Fri Dec 15 17:07:19 UTC 2023 , Edited by admin on Fri Dec 15 17:07:19 UTC 2023
Code System Code Type Description
CAS
541-66-2
Created by admin on Fri Dec 15 17:07:19 UTC 2023 , Edited by admin on Fri Dec 15 17:07:19 UTC 2023
PRIMARY
ChEMBL
CHEMBL2110650
Created by admin on Fri Dec 15 17:07:19 UTC 2023 , Edited by admin on Fri Dec 15 17:07:19 UTC 2023
PRIMARY
INN
4162
Created by admin on Fri Dec 15 17:07:19 UTC 2023 , Edited by admin on Fri Dec 15 17:07:19 UTC 2023
PRIMARY
SMS_ID
100000083031
Created by admin on Fri Dec 15 17:07:19 UTC 2023 , Edited by admin on Fri Dec 15 17:07:19 UTC 2023
PRIMARY
EPA CompTox
DTXSID20968971
Created by admin on Fri Dec 15 17:07:19 UTC 2023 , Edited by admin on Fri Dec 15 17:07:19 UTC 2023
PRIMARY
FDA UNII
3F725G9N2A
Created by admin on Fri Dec 15 17:07:19 UTC 2023 , Edited by admin on Fri Dec 15 17:07:19 UTC 2023
PRIMARY
EVMPD
SUB09500MIG
Created by admin on Fri Dec 15 17:07:19 UTC 2023 , Edited by admin on Fri Dec 15 17:07:19 UTC 2023
PRIMARY
MERCK INDEX
m8292
Created by admin on Fri Dec 15 17:07:19 UTC 2023 , Edited by admin on Fri Dec 15 17:07:19 UTC 2023
PRIMARY Merck Index
PUBCHEM
10939
Created by admin on Fri Dec 15 17:07:19 UTC 2023 , Edited by admin on Fri Dec 15 17:07:19 UTC 2023
PRIMARY
NCI_THESAURUS
C90897
Created by admin on Fri Dec 15 17:07:19 UTC 2023 , Edited by admin on Fri Dec 15 17:07:19 UTC 2023
PRIMARY
Related Record Type Details
Structure of OXAPROPANIUM IODIDE, (-)-
ENANTIOMER -> RACEMATE
Structure of OXAPROPANIUM IODIDE, (+)-
ENANTIOMER -> RACEMATE
Structure of OXAPROPANIUM
PARENT -> SALT/SOLVATE
Related Record Type Details
Structure of OXAPROPANIUM
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