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Details

Stereochemistry ACHIRAL
Molecular Formula 2C14H10Cl2NO2.Ca
Molecular Weight 630.359
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DICLOFENAC CALCIUM

SMILES

[Ca++].[O-]C(=O)CC1=C(NC2=C(Cl)C=CC=C2Cl)C=CC=C1.[O-]C(=O)CC3=C(NC4=C(Cl)C=CC=C4Cl)C=CC=C3

InChI

InChIKey=LUCXOFIZQAAKNM-UHFFFAOYSA-L
InChI=1S/2C14H11Cl2NO2.Ca/c2*15-10-5-3-6-11(16)14(10)17-12-7-2-1-4-9(12)8-13(18)19;/h2*1-7,17H,8H2,(H,18,19);/q;;+2/p-2

HIDE SMILES / InChI

Molecular Formula C14H10Cl2NO2
Molecular Weight 295.141
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula Ca
Molecular Weight 40.078
Charge 2
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 Sat Dec 16 09:11:20 UTC 2023
Edited
by admin
on Sat Dec 16 09:11:20 UTC 2023
Record UNII
PU75M58TSF
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DICLOFENAC CALCIUM
Common Name English
BENZENEACETIC ACID, 2-((2,6-DICHLOROPHENYL)AMINO)-, CALCIUM SALT (2:1)
Systematic Name English
CALCIUM DICLOFENAC
Common Name English
DICLOFENAC CALCIUM SALT
Common Name English
Code System Code Type Description
CAS
88170-10-9
Created by admin on Sat Dec 16 09:11:20 UTC 2023 , Edited by admin on Sat Dec 16 09:11:20 UTC 2023
PRIMARY
PUBCHEM
13239661
Created by admin on Sat Dec 16 09:11:20 UTC 2023 , Edited by admin on Sat Dec 16 09:11:20 UTC 2023
PRIMARY
EPA CompTox
DTXSID70236874
Created by admin on Sat Dec 16 09:11:20 UTC 2023 , Edited by admin on Sat Dec 16 09:11:20 UTC 2023
PRIMARY
FDA UNII
PU75M58TSF
Created by admin on Sat Dec 16 09:11:20 UTC 2023 , Edited by admin on Sat Dec 16 09:11:20 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY