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

Details

Stereochemistry ACHIRAL
Molecular Formula C15H7F7NO3.Na
Molecular Weight 405.1996
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NELONEMDAZ SODIUM

SMILES

[Na+].OC1=CC=C(NCC2=C(F)C(F)=C(C(F)=C2F)C(F)(F)F)C=C1C([O-])=O

InChI

InChIKey=JRUKCFQBEJZBGU-UHFFFAOYSA-M
InChI=1S/C15H8F7NO3.Na/c16-10-7(11(17)13(19)9(12(10)18)15(20,21)22)4-23-5-1-2-8(24)6(3-5)14(25)26;/h1-3,23-24H,4H2,(H,25,26);/q;+1/p-1

HIDE SMILES / InChI

Approval Year

Name Type Language
NELONEMDAZ SODIUM
Common Name English
NEU-2000 SODIUM SALT
Code English
BENZOIC ACID, 2-HYDROXY-5-(((2,3,5,6-TETRAFLUORO-4-(TRIFLUOROMETHYL)PHENYL)METHYL)AMINO)-, SODIUM SALT (1:1)
Systematic Name English
2-HYDROXY-5-((2,3,5,6-TETRAFLUORO-4-(TRIFLUOROMETHYL)PHENYL)METHYLAMINO)BENZOIC ACID, SODIUM HYDRIDE
Systematic Name English
Code System Code Type Description
FDA UNII
MMY7F8FR6C
Created by admin on Sat Dec 16 11:32:10 UTC 2023 , Edited by admin on Sat Dec 16 11:32:10 UTC 2023
PRIMARY
PUBCHEM
23666512
Created by admin on Sat Dec 16 11:32:10 UTC 2023 , Edited by admin on Sat Dec 16 11:32:10 UTC 2023
PRIMARY
CAS
916214-58-9
Created by admin on Sat Dec 16 11:32:10 UTC 2023 , Edited by admin on Sat Dec 16 11:32:10 UTC 2023
PRIMARY