Compound Identification
SMILES
COC1=C(OC)C=C(CCN(C)C(=O)CC(C2=CN=C3C=C(C)C=CN23)C2=CC(=CC=C2)C(F)(F)F)C=C1
InChIKey
InChIKey=WCWCSBDWUULHRY-UHFFFAOYSA-N
Formula
C29H30F3N3O3
Mass
525.572
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Trifluoromethylbenzenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Trifluoromethylbenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Trifluoromethylbenzenes
Alternative Parents
Dimethoxybenzenes Imidazopyridines Imidazo[1,2-a]pyridines Phenoxy compounds Anisoles Alkyl aryl ethers Methylpyridines N-substituted imidazoles Tertiary carboxylic acid amides Heteroaromatic compounds Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organofluorides Alkyl fluorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Trifluoromethylbenzene - O-dimethoxybenzene - Dimethoxybenzene - Imidazo[1,2-a]pyridine - Imidazopyridine - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Methylpyridine - N-substituted imidazole - Pyridine - Azole - Imidazole - Heteroaromatic compound - Tertiary carboxylic acid amide - Carboxamide group - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Ether - Organooxygen compound - Organic oxide - Alkyl fluoride - Hydrocarbon derivative - Organohalogen compound - Organofluoride - Carbonyl group - Organic nitrogen compound - Alkyl halide - Organonitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as trifluoromethylbenzenes. These are organofluorine compounds that contain a benzene ring substituted with one or more trifluoromethyl groups.
External Descriptors
Not available