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Details

Stereochemistry MIXED
Molecular Formula C23H30NO3.Br
Molecular Weight 448.393
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIMETIPIRIUM BROMIDE

SMILES

[Br-].CC1CCC(C)[N+]1(C)CCOC(=O)C(O)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChIKey=OAOFTCGGCRBLAW-UHFFFAOYSA-M
InChI=1S/C23H30NO3.BrH/c1-18-14-15-19(2)24(18,3)16-17-27-22(25)23(26,20-10-6-4-7-11-20)21-12-8-5-9-13-21;/h4-13,18-19,26H,14-17H2,1-3H3;1H/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula C23H29NO3
Molecular Weight 367.4813
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula BrH
Molecular Weight 80.912
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Substance Class Chemical
Created
by admin
on Fri Dec 15 16:22:00 GMT 2023
Edited
by admin
on Fri Dec 15 16:22:00 GMT 2023
Record UNII
0WVM2U8MFI
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIMETIPIRIUM BROMIDE
INN  
INN  
Official Name English
PYRROLIDINIUM, 1-(2-((2-HYDROXY-2,2-DIPHENYLACETYL)OXY)ETHYL)-1,2,5-TRIMETHYL-, BROMIDE (1:1)
Systematic Name English
1-(2-HYDROXYETHYL)-1,2,5-TRIMETHYLPYRROLIDINIUM BROMIDE BENZILATE
Systematic Name English
dimetipirium bromide [INN]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C29704
Created by admin on Fri Dec 15 16:22:00 GMT 2023 , Edited by admin on Fri Dec 15 16:22:00 GMT 2023
Code System Code Type Description
CAS
51047-24-6
Created by admin on Fri Dec 15 16:22:00 GMT 2023 , Edited by admin on Fri Dec 15 16:22:00 GMT 2023
PRIMARY
NCI_THESAURUS
C65407
Created by admin on Fri Dec 15 16:22:00 GMT 2023 , Edited by admin on Fri Dec 15 16:22:00 GMT 2023
PRIMARY
INN
4128
Created by admin on Fri Dec 15 16:22:00 GMT 2023 , Edited by admin on Fri Dec 15 16:22:00 GMT 2023
PRIMARY
FDA UNII
0WVM2U8MFI
Created by admin on Fri Dec 15 16:22:00 GMT 2023 , Edited by admin on Fri Dec 15 16:22:00 GMT 2023
PRIMARY
ChEMBL
CHEMBL2110612
Created by admin on Fri Dec 15 16:22:00 GMT 2023 , Edited by admin on Fri Dec 15 16:22:00 GMT 2023
PRIMARY
EVMPD
SUB07180MIG
Created by admin on Fri Dec 15 16:22:00 GMT 2023 , Edited by admin on Fri Dec 15 16:22:00 GMT 2023
PRIMARY
PUBCHEM
176161
Created by admin on Fri Dec 15 16:22:00 GMT 2023 , Edited by admin on Fri Dec 15 16:22:00 GMT 2023
PRIMARY
SMS_ID
100000082665
Created by admin on Fri Dec 15 16:22:00 GMT 2023 , Edited by admin on Fri Dec 15 16:22:00 GMT 2023
PRIMARY
EPA CompTox
DTXSID90965331
Created by admin on Fri Dec 15 16:22:00 GMT 2023 , Edited by admin on Fri Dec 15 16:22:00 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY