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

Details

Stereochemistry ABSOLUTE
Molecular Formula C10H10Cl3NO3
Molecular Weight 298.55
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CLORACETADOL, (R)-

SMILES

CC(=O)NC1=CC=C(O[C@@H](O)C(Cl)(Cl)Cl)C=C1

InChI

InChIKey=NFZJQAPVHJPJMD-SECBINFHSA-N
InChI=1S/C10H10Cl3NO3/c1-6(15)14-7-2-4-8(5-3-7)17-9(16)10(11,12)13/h2-5,9,16H,1H3,(H,14,15)/t9-/m1/s1

HIDE SMILES / InChI

Molecular Formula C10H10Cl3NO3
Molecular Weight 298.55
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:02:06 GMT 2023
Edited
by admin
on Sat Dec 16 11:02:06 GMT 2023
Record UNII
25YDC89G2T
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CLORACETADOL, (R)-
Common Name English
ACETAMIDE, N-(4-(2,2,2-TRICHLORO-1-HYDROXYETHOXY)PHENYL), (R)-
Systematic Name English
Code System Code Type Description
FDA UNII
25YDC89G2T
Created by admin on Sat Dec 16 11:02:06 GMT 2023 , Edited by admin on Sat Dec 16 11:02:06 GMT 2023
PRIMARY
PUBCHEM
76970787
Created by admin on Sat Dec 16 11:02:06 GMT 2023 , Edited by admin on Sat Dec 16 11:02:06 GMT 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER