Compound Identification
SMILES
[Ca++].[O-]C(=O)C1=CC(OC2=CC=C(Cl)C=C2)=CN1.[O-]C(=O)C1=CC(OC2=CC=C(Cl)C=C2)=CN1
InChIKey
InChIKey=JXPAXGMKZIFHNB-UHFFFAOYSA-L
Formula
C22H14CaCl2N2O6
Mass
513.34
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Ethers
- Level 5 Diarylethers
-
Subclass
Ethers
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Ethers
Intermediate Tree Nodes
Not available
Direct Parent
Diarylethers
Alternative Parents
Pyrrole 2-carboxylic acids Phenoxy compounds Phenol ethers Chlorobenzenes Substituted pyrroles Aryl chlorides Heteroaromatic compounds Carboxylic acid salts Azacyclic compounds Carboxylic acids Organic calcium salts Organic metal halides Organic zwitterions Organic oxides Hydrocarbon derivatives Organochlorides Organonitrogen compounds
Molecular Framework
Not available
Substituents
Diaryl ether - Phenoxy compound - Phenol ether - Pyrrole-2-carboxylic acid - Pyrrole-2-carboxylic acid or derivatives - Chlorobenzene - Halobenzene - Aryl halide - Monocyclic benzene moiety - Benzenoid - Aryl chloride - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Carboxylic acid salt - Organic metal halide - Organic calcium salt - Carboxylic acid - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Organonitrogen compound - Organochloride - Organohalogen compound - Organic zwitterion - Organic nitrogen compound - Hydrocarbon derivative - Organic salt - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as diarylethers. These are organic compounds containing the dialkyl ether functional group, with the formula ROR', where R and R' are aryl groups.
External Descriptors
Not available