Compound Identification
SMILES
COC1=CC(=C(C=C1)C1=CC2=C3N(CCCC2)[C@H]2CCN(C[C@H]2C3=C1)C(=O)OC(C)(C)C)C(F)(F)F
InChIKey
InChIKey=DKDRHJKQZZGQBC-UPVQGACJSA-N
Formula
C28H33F3N2O3
Mass
502.578
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 Piperidinecarboxylic acids Indoles and derivatives Phenoxy compounds Anisoles Methoxybenzenes Dialkylarylamines Alkyl aryl ethers Aralkylamines Azepines Carbamate esters Azacyclic compounds Organofluorides Hydrocarbon derivatives Organic oxides Alkyl fluorides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzazepine - Trifluoromethylbenzene - Indole or derivatives - Piperidinecarboxylic acid - Anisole - Phenoxy compound - Phenol ether - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Methoxybenzene - Alkyl aryl ether - Aralkylamine - Azepine - Benzenoid - Piperidine - Monocyclic benzene moiety - Carbamic acid ester - Tertiary amine - Azacycle - Ether - Organic oxide - Organohalogen compound - Alkyl fluoride - Organofluoride - Carbonyl group - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Alkyl halide - Organic oxygen compound - Amine - 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