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

Details

Stereochemistry ACHIRAL
Molecular Formula C17H14ClFNO3.Na
Molecular Weight 357.739
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of SL-75-102

SMILES

[Na+].OC1=C(C=C(F)C=C1)C(=N\CCCC([O-])=O)\C2=CC=C(Cl)C=C2

InChI

InChIKey=IIZZSPOBOIMENB-SJEOTZHBSA-M
InChI=1S/C17H15ClFNO3.Na/c18-12-5-3-11(4-6-12)17(20-9-1-2-16(22)23)14-10-13(19)7-8-15(14)21;/h3-8,10,21H,1-2,9H2,(H,22,23);/q;+1/p-1/b20-17+;

HIDE SMILES / InChI

Molecular Formula C17H14ClFNO3
Molecular Weight 334.749
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
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 19:41:45 GMT 2023
Edited
by admin
on Fri Dec 15 19:41:45 GMT 2023
Record UNII
EQ5EB8KP2H
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SL-75-102
Common Name English
SL-75102
Common Name English
BUTANOIC ACID, 4-(((4-CHLOROPHENYL)(5-FLUORO-2-HYDROXYPHENYL)METHYLENE)AMINO)-, SODIUM SALT (1:1)
Systematic Name English
Code System Code Type Description
CAS
62665-96-7
Created by admin on Fri Dec 15 19:41:45 GMT 2023 , Edited by admin on Fri Dec 15 19:41:45 GMT 2023
PRIMARY
FDA UNII
EQ5EB8KP2H
Created by admin on Fri Dec 15 19:41:45 GMT 2023 , Edited by admin on Fri Dec 15 19:41:45 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE