Compound Identification
SMILES
O=C(NCCC1=CNC2=CC=CC=C12)C(=CC1=CC(OC2=CC=CC=C2)=CC=C1)C#N
InChIKey
InChIKey=LLDCYMMWTOUOCN-UHFFFAOYSA-N
Formula
C26H21N3O2
Mass
407.473
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
Coumaric acids and derivatives Cinnamic acid amides Diarylethers 3-alkylindoles Phenoxy compounds Phenol ethers Substituted pyrroles Heteroaromatic compounds Secondary carboxylic acid amides Nitriles Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Diphenylether - Cinnamic acid amide - Cinnamic acid or derivatives - Coumaric acid or derivatives - Diaryl ether - 3-alkylindole - Indole - Indole or derivatives - Phenoxy compound - Phenol ether - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Organoheterocyclic compound - Nitrile - Carbonitrile - Carboxylic acid derivative - Ether - Carbonyl group - Organic oxide - Cyanide - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic 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