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Details

Stereochemistry MIXED
Molecular Formula C20H30NO3.Br
Molecular Weight 412.361
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HEXOPYRRONIUM BROMIDE

SMILES

[Br-].C[N+]1(C)CCC(C1)OC(=O)C(O)(C2CCCCC2)C3=CC=CC=C3

InChI

InChIKey=YEVVXURMULIHJU-UHFFFAOYSA-M
InChI=1S/C20H30NO3.BrH/c1-21(2)14-13-18(15-21)24-19(22)20(23,16-9-5-3-6-10-16)17-11-7-4-8-12-17;/h3,5-6,9-10,17-18,23H,4,7-8,11-15H2,1-2H3;1H/q+1;/p-1

HIDE SMILES / InChI

Approval Year

Name Type Language
HEXOPYRRONIUM BROMIDE
INN  
INN  
Official Name English
1,1-DIMETHYL-3-HYDROXY-PYRROLIDINIUM BROMIDE .ALPHA.-PHENYL-CYCLOHEXANEGLYCOLATE
Systematic Name English
hexopyrronium bromide [INN]
Common Name English
HEXOPYRROLATE
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C29704
Created by admin on Fri Dec 15 14:59:20 UTC 2023 , Edited by admin on Fri Dec 15 14:59:20 UTC 2023
Code System Code Type Description
NCI_THESAURUS
C83757
Created by admin on Fri Dec 15 14:59:20 UTC 2023 , Edited by admin on Fri Dec 15 14:59:20 UTC 2023
PRIMARY
INN
1280
Created by admin on Fri Dec 15 14:59:20 UTC 2023 , Edited by admin on Fri Dec 15 14:59:20 UTC 2023
PRIMARY
CAS
3734-12-1
Created by admin on Fri Dec 15 14:59:20 UTC 2023 , Edited by admin on Fri Dec 15 14:59:20 UTC 2023
PRIMARY
SMS_ID
100000083981
Created by admin on Fri Dec 15 14:59:20 UTC 2023 , Edited by admin on Fri Dec 15 14:59:20 UTC 2023
PRIMARY
EVMPD
SUB08042MIG
Created by admin on Fri Dec 15 14:59:20 UTC 2023 , Edited by admin on Fri Dec 15 14:59:20 UTC 2023
PRIMARY
EPA CompTox
DTXSID40958450
Created by admin on Fri Dec 15 14:59:20 UTC 2023 , Edited by admin on Fri Dec 15 14:59:20 UTC 2023
PRIMARY
FDA UNII
AP73B5SGYV
Created by admin on Fri Dec 15 14:59:20 UTC 2023 , Edited by admin on Fri Dec 15 14:59:20 UTC 2023
PRIMARY
PUBCHEM
19512
Created by admin on Fri Dec 15 14:59:20 UTC 2023 , Edited by admin on Fri Dec 15 14:59:20 UTC 2023
PRIMARY
ChEMBL
CHEMBL2110685
Created by admin on Fri Dec 15 14:59:20 UTC 2023 , Edited by admin on Fri Dec 15 14:59:20 UTC 2023
PRIMARY