Compound Identification
SMILES
CC(C)CC(OC(C1=CC=C(Br)C=C1)C1=CC=CC=N1)C(=O)NCC#N
InChIKey
InChIKey=FYZHORQDRFFAJH-UHFFFAOYSA-N
Formula
C20H22BrN3O2
Mass
416.319
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzylethers
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzylethers
Intermediate Tree Nodes
Not available
Direct Parent
Benzylethers
Alternative Parents
Bromobenzenes Pyridines and derivatives N-acyl amines Aryl bromides Heteroaromatic compounds Secondary carboxylic acid amides Nitriles Dialkyl ethers Azacyclic compounds Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzylether - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Fatty amide - Fatty acyl - Pyridine - N-acyl-amine - Heteroaromatic compound - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Dialkyl ether - Ether - Azacycle - Organoheterocyclic compound - Carbonitrile - Nitrile - Cyanide - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organohalogen compound - Organobromide - Organonitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzylethers. These are aromatic ethers with the general formula ROCR' (R = alkyl, aryl; R'=benzene).
External Descriptors
Not available