Compound Identification
SMILES
CC1=CC(CCC#N)=CC(C)=C1OC1=CC(NC2=CC=C(C=C2)C#N)=C(N)C=C1C(O)=O
InChIKey
InChIKey=LCDPGALFBOQNJT-UHFFFAOYSA-N
Formula
C25H22N4O3
Mass
426.476
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Diphenylethers
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Diphenylethers
Intermediate Tree Nodes
Not available
Direct Parent
Diphenylethers
Alternative Parents
Diarylethers Aminobenzoic acids Benzoic acids m-Xylenes Aniline and substituted anilines Benzonitriles Benzoyl derivatives Phenol ethers Phenoxy compounds Primary aromatic amines Amino acids Carboxylic acids Nitriles Secondary amines Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Diphenylether - Diaryl ether - Aminobenzoic acid - Aminobenzoic acid or derivatives - Benzoic acid or derivatives - Benzoic acid - Phenoxy compound - M-xylene - Xylene - Benzonitrile - Benzoyl - Aniline or substituted anilines - Phenol ether - Primary aromatic amine - Amino acid or derivatives - Amino acid - Nitrile - Carbonitrile - Ether - Secondary amine - Carboxylic acid - Carboxylic acid derivative - Organonitrogen compound - Hydrocarbon derivative - Amine - Organic oxide - Cyanide - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Primary amine - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as diphenylethers. These are aromatic compounds containing two benzene rings linked to each other through an ether group.
External Descriptors
Not available