Compound Identification
SMILES
Cl.Cl.CCC(=O)OCCN1CCN(CCN2CCCC(C3=CC=C(F)C=C3)C3=C2C=C(F)C=C3)CC1
InChIKey
InChIKey=MTFDPDTUTPFQBM-UHFFFAOYSA-N
Formula
C27H37Cl2F2N3O2
Mass
544.51
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
Dialkylarylamines Aralkylamines Azepines Fluorobenzenes N-alkylpiperazines Aryl fluorides Trialkylamines Carboxylic acid esters Amino acids and derivatives Monocarboxylic acids and derivatives Azacyclic compounds Hydrochlorides Hydrocarbon derivatives Carbonyl compounds Organic oxides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzazepine - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Fluorobenzene - Azepine - Halobenzene - Aralkylamine - N-alkylpiperazine - Aryl fluoride - Aryl halide - Benzenoid - 1,4-diazinane - Monocyclic benzene moiety - Piperazine - Amino acid or derivatives - Tertiary aliphatic amine - Carboxylic acid ester - Tertiary amine - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Azacycle - Amine - Organohalogen compound - Organofluoride - Organonitrogen compound - Carbonyl group - Organooxygen compound - Hydrochloride - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - 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