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Details

Stereochemistry ACHIRAL
Molecular Formula C20H22NO4.Na
Molecular Weight 363.3827
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of EFAPROXIRAL SODIUM

SMILES

[Na+].CC1=CC(NC(=O)CC2=CC=C(OC(C)(C)C([O-])=O)C=C2)=CC(C)=C1

InChI

InChIKey=SWDPIHPGORBMFR-UHFFFAOYSA-M
InChI=1S/C20H23NO4.Na/c1-13-9-14(2)11-16(10-13)21-18(22)12-15-5-7-17(8-6-15)25-20(3,4)19(23)24;/h5-11H,12H2,1-4H3,(H,21,22)(H,23,24);/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula C20H22NO4
Molecular Weight 340.393
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula Na
Molecular Weight 22.9898
Charge 1
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 15:39:17 UTC 2023
Edited
by admin
on Fri Dec 15 15:39:17 UTC 2023
Record UNII
3L83QP52XI
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
EFAPROXIRAL SODIUM
MART.   USAN   WHO-DD  
USAN  
Official Name English
RSR13 SODIUM
Code English
2-[4-[2-[(3,5-Dimethylphenyl)amino]-2-oxoethyl]phenoxy]-2-methylpropanoic acid monosodium salt
Common Name English
EFAPROXIRAL SODIUM [USAN]
Common Name English
2-(4-(((3,5-DIMETHYLANILINO)CARBONYL)METHYL)-PHENOXY)-2-METHYLPROPIONIC ACID SODIUM
Systematic Name English
EFAPROXIRAL SODIUM [MART.]
Common Name English
RSR-13 SODIUM
Code English
PROPANOIC ACID, 2-(4-(2-((3,5-DIMETHYLPHENYL)AMINO)-2-OXOETHYL)PHENOXY)-2-METHYL-, MONOSODIUM SALT
Common Name English
Efaproxiral sodium [WHO-DD]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C798
Created by admin on Fri Dec 15 15:39:17 UTC 2023 , Edited by admin on Fri Dec 15 15:39:17 UTC 2023
Code System Code Type Description
USAN
NN-12
Created by admin on Fri Dec 15 15:39:17 UTC 2023 , Edited by admin on Fri Dec 15 15:39:17 UTC 2023
PRIMARY
ChEMBL
CHEMBL18901
Created by admin on Fri Dec 15 15:39:17 UTC 2023 , Edited by admin on Fri Dec 15 15:39:17 UTC 2023
PRIMARY
FDA UNII
3L83QP52XI
Created by admin on Fri Dec 15 15:39:17 UTC 2023 , Edited by admin on Fri Dec 15 15:39:17 UTC 2023
PRIMARY
CAS
170787-99-2
Created by admin on Fri Dec 15 15:39:17 UTC 2023 , Edited by admin on Fri Dec 15 15:39:17 UTC 2023
PRIMARY
EPA CompTox
DTXSID50168942
Created by admin on Fri Dec 15 15:39:17 UTC 2023 , Edited by admin on Fri Dec 15 15:39:17 UTC 2023
PRIMARY
PUBCHEM
2725048
Created by admin on Fri Dec 15 15:39:17 UTC 2023 , Edited by admin on Fri Dec 15 15:39:17 UTC 2023
PRIMARY
SMS_ID
300000001260
Created by admin on Fri Dec 15 15:39:17 UTC 2023 , Edited by admin on Fri Dec 15 15:39:17 UTC 2023
PRIMARY
NCI_THESAURUS
C72748
Created by admin on Fri Dec 15 15:39:17 UTC 2023 , Edited by admin on Fri Dec 15 15:39:17 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY