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Details

Stereochemistry ABSOLUTE
Molecular Formula C15H21N3O.C6H8O7
Molecular Weight 451.4703
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Cizolirtine citrate, (R)-

SMILES

OC(=O)CC(O)(CC(O)=O)C(O)=O.CN(C)CCO[C@@H](C1=CC=NN1C)C2=CC=CC=C2

InChI

InChIKey=JLKUMSHHQYQLSG-XFULWGLBSA-N
InChI=1S/C15H21N3O.C6H8O7/c1-17(2)11-12-19-15(13-7-5-4-6-8-13)14-9-10-16-18(14)3;7-3(8)1-6(13,5(11)12)2-4(9)10/h4-10,15H,11-12H2,1-3H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/t15-;/m1./s1

HIDE SMILES / InChI

Molecular Formula C15H21N3O
Molecular Weight 259.3467
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula C6H8O7
Molecular Weight 192.1235
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 Mon Mar 31 23:43:23 GMT 2025
Edited
by admin
on Mon Mar 31 23:43:23 GMT 2025
Record UNII
X46HGD2GYX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Cizolirtine citrate, (R)-
Common Name English
(+)-5-(.ALPHA.-(2-(DIMETHYLAMINO)ETHOXY)BENZYL)-1-METHYL-1H-PYRAZOLE CITRATE
Preferred Name English
ETHANAMINE, N,N-DIMETHYL-2-((R)-(1-METHYL-1H-PYRAZOL-5-YL)PHENYLMETHOXY)-, 2-HYDROXY-1,2,3-PROPANETRICARBOXYLATE, (R)-
Systematic Name English
Code System Code Type Description
PUBCHEM
10114897
Created by admin on Mon Mar 31 23:43:23 GMT 2025 , Edited by admin on Mon Mar 31 23:43:23 GMT 2025
PRIMARY
CAS
148981-63-9
Created by admin on Mon Mar 31 23:43:23 GMT 2025 , Edited by admin on Mon Mar 31 23:43:23 GMT 2025
PRIMARY
FDA UNII
X46HGD2GYX
Created by admin on Mon Mar 31 23:43:23 GMT 2025 , Edited by admin on Mon Mar 31 23:43:23 GMT 2025
PRIMARY