Compound Identification
SMILES
Cl.CN1C2=C(CNCCC2)C2=C1C=C(C=C2)N1C=CC(OCC2=C(Cl)C=C(Cl)C=C2)=CC1=O
InChIKey
InChIKey=IIOAMDZRYOLKGJ-UHFFFAOYSA-N
Formula
C25H24Cl3N3O2
Mass
504.84
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 Dichlorobenzenes Pyridinones Alkyl aryl ethers Aralkylamines Azepines Dihydropyridines N-methylpyrroles Aryl chlorides Vinylogous esters Heteroaromatic compounds Lactams Dialkylamines Azacyclic compounds Hydrochlorides Organic oxides Hydrocarbon derivatives Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-alkylindole - Pyrroloazepine - 3-alkylindole - Indole or derivatives - Indole - 1,3-dichlorobenzene - Alkyl aryl ether - Azepine - Pyridinone - Chlorobenzene - Aralkylamine - Dihydropyridine - Halobenzene - Substituted pyrrole - Benzenoid - Hydropyridine - Monocyclic benzene moiety - Pyridine - Aryl halide - Aryl chloride - N-methylpyrrole - Heteroaromatic compound - Vinylogous ester - Pyrrole - Lactam - Secondary amine - Ether - Secondary aliphatic amine - Azacycle - Organonitrogen compound - Organooxygen compound - Amine - Hydrochloride - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen 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