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

Details

Stereochemistry ABSOLUTE
Molecular Formula C16H19ClO2
Molecular Weight 278.774
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

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

SMILES

OC(=O)[C@@H]1CCC2=C1C=C(Cl)C(=C2)C3CCCCC3

InChI

InChIKey=OIRAEJWYWSAQNG-GFCCVEGCSA-N
InChI=1S/C16H19ClO2/c17-15-9-13-11(6-7-12(13)16(18)19)8-14(15)10-4-2-1-3-5-10/h8-10,12H,1-7H2,(H,18,19)/t12-/m1/s1

HIDE SMILES / InChI

Molecular Formula C16H19ClO2
Molecular Weight 278.774
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 08:28:28 GMT 2023
Edited
by admin
on Sat Dec 16 08:28:28 GMT 2023
Record UNII
NA431U049C
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CLIDANAC, (R)-
Common Name English
1H-INDENE-1-CARBOXYLIC ACID, 6-CHLORO-5-CYCLOHEXYL-2,3-DIHYDRO-, (1R)-
Systematic Name English
(-)-CLIDANAC
Common Name English
(1R)-(-)-6-CHLORO-5-CYCLOHEXYLINDAN-1-CARBOXYLIC ACID
Systematic Name English
L-TAI-284
Common Name English
(R)-(-)-CLIDANAC
Common Name English
(-)-TAI-284
Common Name English
CLIDANAC (R)-(-)-FORM [MI]
Common Name English
CLIDANAC, (-)-
Common Name English
Code System Code Type Description
PUBCHEM
51397065
Created by admin on Sat Dec 16 08:28:28 GMT 2023 , Edited by admin on Sat Dec 16 08:28:28 GMT 2023
PRIMARY
CAS
28998-45-0
Created by admin on Sat Dec 16 08:28:28 GMT 2023 , Edited by admin on Sat Dec 16 08:28:28 GMT 2023
PRIMARY
EPA CompTox
DTXSID50680119
Created by admin on Sat Dec 16 08:28:28 GMT 2023 , Edited by admin on Sat Dec 16 08:28:28 GMT 2023
PRIMARY
FDA UNII
NA431U049C
Created by admin on Sat Dec 16 08:28:28 GMT 2023 , Edited by admin on Sat Dec 16 08:28:28 GMT 2023
PRIMARY
MERCK INDEX
m654
Created by admin on Sat Dec 16 08:28:28 GMT 2023 , Edited by admin on Sat Dec 16 08:28:28 GMT 2023
PRIMARY Merck Index
Related Record Type Details
RACEMATE -> ENANTIOMER