Compound Identification
SMILES
CN1C=NC=C1[C@@](C)(N)C1=CC(OC2=CC=CC(=C2)[C@@]2(CCC(F)(F)F)CCCCN(C)C2=O)=C(C=C1)C#N
InChIKey
InChIKey=CPCCCCDBCSOFNS-NSOVKSMOSA-N
Formula
C29H32F3N5O2
Mass
539.603
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 Phenoxy compounds Phenol ethers Benzonitriles Caprolactams Aralkylamines Azepanes N-substituted imidazoles Tertiary carboxylic acid amides Heteroaromatic compounds Amino acids and derivatives Nitriles Azacyclic compounds Monoalkylamines Carbonyl compounds Organic oxides Organofluorides Alkyl fluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Diphenylether - Diaryl ether - Phenoxy compound - Benzonitrile - Caprolactam - Phenol ether - Azepane - Aralkylamine - N-substituted imidazole - Azole - Heteroaromatic compound - Tertiary carboxylic acid amide - Imidazole - Amino acid or derivatives - Carboxamide group - Lactam - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Ether - Carbonitrile - Nitrile - Organooxygen compound - Primary amine - Organic nitrogen compound - Amine - Alkyl halide - Alkyl fluoride - Carbonyl group - Hydrocarbon derivative - Organic oxide - Cyanide - Primary aliphatic amine - Organonitrogen compound - Organic oxygen compound - Organohalogen compound - Organofluoride - 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