Compound Identification
SMILES
CC[C@@]1(CCCCN(C)C1=O)C1=CC(OC2=C(C=CC(CN3C(C)=NC=C3CCN(C)C)=C2)C#N)=CC=C1
InChIKey
InChIKey=AUFILOVTNXOKBW-WJOKGBTCSA-N
Formula
C31H39N5O2
Mass
513.686
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 1,2,5-trisubstituted imidazoles Phenoxy compounds Phenol ethers Benzonitriles Caprolactams Aralkylamines Azepanes N-substituted imidazoles Tertiary carboxylic acid amides Heteroaromatic compounds Trialkylamines Amino acids and derivatives Nitriles Azacyclic compounds Hydrocarbon derivatives Organic oxides Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Diphenylether - Diaryl ether - 1,2,5-trisubstituted-imidazole - Phenoxy compound - Benzonitrile - Phenol ether - Caprolactam - Trisubstituted imidazole - Azepane - Aralkylamine - N-substituted imidazole - Imidazole - Azole - Heteroaromatic compound - Tertiary carboxylic acid amide - Amino acid or derivatives - Tertiary amine - Lactam - Tertiary aliphatic amine - Carboxamide group - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Nitrile - Carbonitrile - Amine - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Cyanide - Organic oxide - Aromatic heteromonocyclic 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