U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C20H25NO3.CH4O3S
Molecular Weight 423.523
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TRAXOPRODIL MESYLATE ANHYDROUS

SMILES

CS(O)(=O)=O.C[C@@H]([C@@H](O)C1=CC=C(O)C=C1)N2CCC(O)(CC2)C3=CC=CC=C3

InChI

InChIKey=OZBWUANKVIMZIA-WRRDZZDISA-N
InChI=1S/C20H25NO3.CH4O3S/c1-15(19(23)16-7-9-18(22)10-8-16)21-13-11-20(24,12-14-21)17-5-3-2-4-6-17;1-5(2,3)4/h2-10,15,19,22-24H,11-14H2,1H3;1H3,(H,2,3,4)/t15-,19+;/m0./s1

HIDE SMILES / InChI

Approval Year

Name Type Language
TRAXOPRODIL MESYLATE ANHYDROUS
Common Name English
Traxoprodil mesilate [WHO-DD]
Common Name English
1-PIPERIDINEETHANOL, 4-HYDROXY-.ALPHA.-(4-HYDROXYPHENYL)-.BETA.-METHYL-4-PHENYL-, (.ALPHA.S,.BETA.S)-, METHANESULFONATE (1:1)
Common Name English
TRAXOPRODIL MESILATE
WHO-DD  
Common Name English
(.ALPHA.S,.BETA.S)-4-HYDROXY-.ALPHA.-(P-HYDROXYPHENYL)-.BETA.-METHYL-4-PHENYL-1-PIPERIDINEETHANOL METHANESULFONATE (SALT)
Common Name English
1-PIPERIDINEETHANOL, 4-HYDROXY-.ALPHA.-(4-HYDROXYPHENYL)-.BETA.-METHYL-4-PHENYL-, (S-(R*,R*))-, METHANESULFONATE (SALT)
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID40172230
Created by admin on Sat Dec 16 05:45:07 UTC 2023 , Edited by admin on Sat Dec 16 05:45:07 UTC 2023
PRIMARY
FDA UNII
I23V4CCC9V
Created by admin on Sat Dec 16 05:45:07 UTC 2023 , Edited by admin on Sat Dec 16 05:45:07 UTC 2023
PRIMARY
CAS
188591-67-5
Created by admin on Sat Dec 16 05:45:07 UTC 2023 , Edited by admin on Sat Dec 16 05:45:07 UTC 2023
PRIMARY
PUBCHEM
9802399
Created by admin on Sat Dec 16 05:45:07 UTC 2023 , Edited by admin on Sat Dec 16 05:45:07 UTC 2023
PRIMARY