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, (S)-

SMILES

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

InChI

InChIKey=NFZJQAPVHJPJMD-VIFPVBQESA-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-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
CLORACETADOL, (S)-
Common Name English
ACETAMIDE, N-(4-(2,2,2-TRICHLORO-1-HYDROXYETHOXY)PHENYL), (S)-
Systematic Name English
Code System Code Type Description
FDA UNII
W4W1M96RG5
Created by admin on Sat Dec 16 18:30:23 GMT 2023 , Edited by admin on Sat Dec 16 18:30:23 GMT 2023
PRIMARY
PUBCHEM
76970786
Created by admin on Sat Dec 16 18:30:23 GMT 2023 , Edited by admin on Sat Dec 16 18:30:23 GMT 2023
PRIMARY