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Details

Stereochemistry MIXED
Molecular Formula C24H36NO4.Br
Molecular Weight 482.451
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6-METHOXYPSEUDOTROPINE PHENYLCYCLOHEXYLGLYCOLIC ACID ESTER METHYL BROMIDE

SMILES

[Br-].COC1C[C@H]2CC(C[C@@H]1[N+]2(C)C)OC(=O)C(O)(C3CCCCC3)C4=CC=CC=C4

InChI

InChIKey=HWXGUEISIPECIN-NSOVRXJMSA-M
InChI=1S/C24H36NO4.BrH/c1-25(2)19-14-20(16-21(25)22(15-19)28-3)29-23(26)24(27,17-10-6-4-7-11-17)18-12-8-5-9-13-18;/h4,6-7,10-11,18-22,27H,5,8-9,12-16H2,1-3H3;1H/q+1;/p-1/t19-,20?,21+,22?,24?;/m1./s1

HIDE SMILES / InChI

Molecular Formula C24H35NO4
Molecular Weight 401.539
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 2 / 5
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

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:05:09 GMT 2023
Edited
by admin
on Fri Dec 15 15:05:09 GMT 2023
Record UNII
I0C8YMV6PC
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6-METHOXYPSEUDOTROPINE PHENYLCYCLOHEXYLGLYCOLIC ACID ESTER METHYL BROMIDE
Common Name English
1.ALPHA.H,5.ALPHA.H-TROPANIUM, 3.BETA.-HYDROXY-6-METHOXY-8-METHYL-, BROMIDE, .ALPHA.-PHENYLCYCLOHEXANEGLYCOLATE
Common Name English
8-AZONIABICYCLO(3.2.1)OCTANE, 3-((2-CYCLOHEXYL-2-HYDROXY-2-PHENYLACETYL)OXY)-6-METHOXY-8,8-DIMETHYL-, BROMIDE (1:1)
Systematic Name English
6-METHOXYPSEUDOTROPINE METHYL BROMIDE, .ALPHA.-PHENYLCYCLOHEXANEGLYCOLATE
Common Name English
Code System Code Type Description
FDA UNII
I0C8YMV6PC
Created by admin on Fri Dec 15 15:05:09 GMT 2023 , Edited by admin on Fri Dec 15 15:05:09 GMT 2023
PRIMARY
PUBCHEM
135390970
Created by admin on Fri Dec 15 15:05:09 GMT 2023 , Edited by admin on Fri Dec 15 15:05:09 GMT 2023
PRIMARY
CAS
23325-75-9
Created by admin on Fri Dec 15 15:05:09 GMT 2023 , Edited by admin on Fri Dec 15 15:05:09 GMT 2023
PRIMARY