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Details

Stereochemistry RACEMIC
Molecular Formula C20H28NO4.CH3O4S
Molecular Weight 457.538
Optical Activity ( + / - )
Defined Stereocenters 3 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TEMATROPIUM METHYLSULFATE

SMILES

COS([O-])(=O)=O.CCOC(=O)C(C(=O)O[C@@H]1C[C@@H]2CC[C@H](C1)[N+]2(C)C)C3=CC=CC=C3

InChI

InChIKey=YLMCBOIUJONUGH-PBHNUWRFSA-M
InChI=1S/C20H28NO4.CH4O4S/c1-4-24-19(22)18(14-8-6-5-7-9-14)20(23)25-17-12-15-10-11-16(13-17)21(15,2)3;1-5-6(2,3)4/h5-9,15-18H,4,10-13H2,1-3H3;1H3,(H,2,3,4)/q+1;/p-1/t15-,16+,17+,18?;

HIDE SMILES / InChI

Approval Year

Name Type Language
TEMATROPIUM METHYLSULFATE
USAN  
USAN  
Official Name English
HGP-6
Code English
TEMATROPIUM METILSULFATE
INN  
INN  
Official Name English
TEMATROPIUM METHYLSULPHATE
Common Name English
TEMATROPIUM METILSULPHATE
Common Name English
8-AZONIABICYCLO(3.2.1)OCTANE, 3-(3-ETHOXY-1,3-DIOXO-2-PHENYLPROPOXY)-8,8-DIMETHYL-, ENDO-(±)-, METHYL SULPHATE
Systematic Name English
CDDD-3602
Code English
8-AZONIABICYCLO(3.2.1)OCTANE, 3-(3-ETHOXY-1,3-DIOXO-2-PHENYLPROPOXY)-8,8-DIMETHYL-, ENDO-(±)-, METHYL SULFATE
Systematic Name English
tematropium metilsulfate [INN]
Common Name English
CDDD 3602
Code English
TEMATROPIUM METHYLSULFATE [USAN]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C66880
Created by admin on Fri Dec 15 15:32:56 UTC 2023 , Edited by admin on Fri Dec 15 15:32:56 UTC 2023
Code System Code Type Description
EVMPD
SUB10879MIG
Created by admin on Fri Dec 15 15:32:56 UTC 2023 , Edited by admin on Fri Dec 15 15:32:56 UTC 2023
PRIMARY
PUBCHEM
23725042
Created by admin on Fri Dec 15 15:32:56 UTC 2023 , Edited by admin on Fri Dec 15 15:32:56 UTC 2023
PRIMARY
SMS_ID
100000082445
Created by admin on Fri Dec 15 15:32:56 UTC 2023 , Edited by admin on Fri Dec 15 15:32:56 UTC 2023
PRIMARY
FDA UNII
2T52M232D8
Created by admin on Fri Dec 15 15:32:56 UTC 2023 , Edited by admin on Fri Dec 15 15:32:56 UTC 2023
PRIMARY
ChEMBL
CHEMBL2111140
Created by admin on Fri Dec 15 15:32:56 UTC 2023 , Edited by admin on Fri Dec 15 15:32:56 UTC 2023
PRIMARY
EPA CompTox
DTXSID60921242
Created by admin on Fri Dec 15 15:32:56 UTC 2023 , Edited by admin on Fri Dec 15 15:32:56 UTC 2023
PRIMARY
USAN
BB-84
Created by admin on Fri Dec 15 15:32:56 UTC 2023 , Edited by admin on Fri Dec 15 15:32:56 UTC 2023
PRIMARY
INN
6667
Created by admin on Fri Dec 15 15:32:56 UTC 2023 , Edited by admin on Fri Dec 15 15:32:56 UTC 2023
PRIMARY
NCI_THESAURUS
C152550
Created by admin on Fri Dec 15 15:32:56 UTC 2023 , Edited by admin on Fri Dec 15 15:32:56 UTC 2023
PRIMARY
CAS
113932-41-5
Created by admin on Fri Dec 15 15:32:56 UTC 2023 , Edited by admin on Fri Dec 15 15:32:56 UTC 2023
PRIMARY