Diclofenac

Systematic / IUPAC Name: 2-[2-(2,6-Dichloroanilino)phenyl]acetic acid

ID: Reference692

Other Names: Apo-diclo;
Dichlofenac;
Diclophenac;
Dicloreuma;
M-Diclo ; more

Formula: C14H11Cl2NO2

Class: Therapeutics/Prescription Drugs

Spectral Data

Diclofenac mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments LTQ Orbitrap XL; Q Exactive Orbitrap
No. of Spectral Trees 4
No. of Spectra 327
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 10/12/2016 7:52:03 AM
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Identificators

InChI InChI=1S/C14H11Cl2NO2/c15-10-5-3-6-11(16)14(10)17-12-7-2-1-4-9(12)8-13(18)19/h1-7,17H,8H2,(H,18,19)
InChI Key DCOPUUMXTXDBNB-UHFFFAOYSA-N
Canonical SMILES C1=CC=C(C(=C1)CC(=O)O)NC2=C(C=CC=C2Cl)Cl
CAS 15307865
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Other Names Apo-diclo;
Dichlofenac;
Diclophenac;
Dicloreuma;
M-Diclo;
Novo-difenac;
Pennsaid;
Prosorb-D;
Solaraze T;
Voltaren-XR;
2-(2,6-Dichloroanilino)phenylacetic acid;
2-[2,6-(Dichlorophenyl)amino]benzeneacetic acid ;
2-{2-[(2,6-Dichlorophenyl)amino]phenyl}acetic acid ;
Acetic acid, [o-(2,6-dichloroanilino)phenyl]- ;
Benzeneacetic acid, 2-[(2,6-dichlorophenyl)amino]-

In Other Databases

Wikipedia Diclofenac
ChemIDPlus 015307796; 015307865; 015307810; 119623664; 078213168; 239810538
ChEMBL CHEMBL139
PubChem 3033
ChEBI CHEBI:47381
HMDb HMDB14724
DrugBank APRD00527
KEGG C01690; D00903; D00904; D07816
ChemSpider 2925