Compound Identification
SMILES
Cl.ClC1=CC=C(OCCN2C3=C(CCNCC3)C3=CC(Cl)=C(Cl)C=C23)C=C1
InChIKey
InChIKey=CHDQGJDKTDKHPU-UHFFFAOYSA-N
Formula
C20H20Cl4N2O
Mass
446.19
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Pyrroloazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrroloazepines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Pyrroloazepines
Alternative Parents
3-alkylindoles N-alkylindoles Phenoxy compounds Phenol ethers Alkyl aryl ethers Aralkylamines Chlorobenzenes Azepines Substituted pyrroles Aryl chlorides Heteroaromatic compounds Dialkylamines Azacyclic compounds Hydrocarbon derivatives Organochlorides Hydrochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-alkylindole - Pyrroloazepine - 3-alkylindole - Indole - Indole or derivatives - Phenol ether - Phenoxy compound - Halobenzene - Alkyl aryl ether - Chlorobenzene - Azepine - Aralkylamine - Substituted pyrrole - Aryl halide - Benzenoid - Aryl chloride - Monocyclic benzene moiety - Pyrrole - Heteroaromatic compound - Azacycle - Secondary amine - Secondary aliphatic amine - Ether - Organic oxygen compound - Amine - Hydrochloride - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrroloazepines. These are compounds containing a pyrroloazepine moiety, which is a bicyclic heterocycle which consists of a pyrrole ring fused to an azepine. Pyrrole is 5-membered ring consisting of four carbon atoms and one nitrogen atom. Azepine is a 7-membered ring consisting of six carbon and one nitrogen atom.
External Descriptors
Not available