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Details

Stereochemistry RACEMIC
Molecular Formula C19H27ClNO3
Molecular Weight 352.876
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 1

SHOW SMILES / InChI
Structure of CHLOROGLYCOPYRROLATE

SMILES

C[N+]1(C)CC[C@@H](C1)OC(=O)[C@@](O)(C2CCCC2)C3=CC=C(Cl)C=C3

InChI

InChIKey=PEDMBHQOOUINFV-PKOBYXMFSA-N
InChI=1S/C19H27ClNO3/c1-21(2)12-11-17(13-21)24-18(22)19(23,14-5-3-4-6-14)15-7-9-16(20)10-8-15/h7-10,14,17,23H,3-6,11-13H2,1-2H3/q+1/t17-,19+/m0/s1

HIDE SMILES / InChI

Molecular Formula C19H26ClNO3
Molecular Weight 351.868
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 05:09:27 GMT 2023
Edited
by admin
on Sat Dec 16 05:09:27 GMT 2023
Record UNII
L0XW1R6D3S
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CHLOROGLYCOPYRROLATE
Common Name English
GLYCOPYRROLATE RELATED COMPOUND I [USP IMPURITY]
Common Name English
(±)-(3RS)-3-((2SR)-(2-(4-CHLOROPHENYL)-2-CYCLOPENTYL-2-HYDROXYACETYL)OXY)-1,1-DIMETHYLPYRROLIDINIUM
Systematic Name English
GLYCOPYRRONIUM BROMIDE IMPURITY I [EP IMPURITY]
Common Name English
CHLOROGLYCOPYRRONIUM
Common Name English
(3RS)-3-((2SR)-(2-(4-CHLOROPHENYL)-2-CYCLOPENTYL-2-HYDROXYACETYL)OXY)-1,1-DIMETHYLPYRROLIDINIUM
Systematic Name English
GLYCOPYRROLATE RELATED COMPOUND I [USP-RS]
Common Name English
CHLOROGLYCOPYRRONIUM CATION
Common Name English
PYRROLIDINIUM, 3-((2-(4-CHLOROPHENYL)-2-CYCLOPENTYL-2-HYDROXYACETYL)OXY)-1,1-DIMETHYL-
Systematic Name English
Code System Code Type Description
FDA UNII
L0XW1R6D3S
Created by admin on Sat Dec 16 05:09:28 GMT 2023 , Edited by admin on Sat Dec 16 05:09:28 GMT 2023
PRIMARY
EPA CompTox
DTXSID80161406
Created by admin on Sat Dec 16 05:09:28 GMT 2023 , Edited by admin on Sat Dec 16 05:09:28 GMT 2023
PRIMARY
RS_ITEM_NUM
1296086
Created by admin on Sat Dec 16 05:09:28 GMT 2023 , Edited by admin on Sat Dec 16 05:09:28 GMT 2023
PRIMARY
PUBCHEM
71588004
Created by admin on Sat Dec 16 05:09:28 GMT 2023 , Edited by admin on Sat Dec 16 05:09:28 GMT 2023
PRIMARY
CAS
1404617-94-2
Created by admin on Sat Dec 16 05:09:28 GMT 2023 , Edited by admin on Sat Dec 16 05:09:28 GMT 2023
NON-SPECIFIC STEREOCHEMISTRY
Related Record Type Details
SALT/SOLVATE -> PARENT
Related Record Type Details
PARENT -> IMPURITY