Compound Identification
SMILES
CC(=O)N(CC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C1CCCN(C(O)=O)C2=C1C=CC(Br)=C2
InChIKey
InChIKey=WXRYDBMHIYOVAS-UHFFFAOYSA-N
Formula
C22H19BrF6N2O3
Mass
553.299
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzazepines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzazepines
Alternative Parents
Trifluoromethylbenzenes Azepines Aryl bromides Tertiary carboxylic acid amides Acetamides Carbamic acids Azacyclic compounds Organonitrogen compounds Organofluorides Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzazepine - Trifluoromethylbenzene - Azepine - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Tertiary carboxylic acid amide - Acetamide - Carbamic acid - Carbamic acid derivative - Carboxamide group - Azacycle - Carboxylic acid derivative - Organic oxide - Organohalogen compound - Organobromide - Carbonyl group - Organofluoride - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Organooxygen compound - Alkyl fluoride - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzazepines. These are organic compounds containing a benzene ring fused to an azepine ring (unsaturated seven-membered heterocycle with one nitrogen atom replacing a carbon atom).
External Descriptors
Not available