Compound Identification
SMILES
BrC1=C2C3=C(CCNCC3)N3CCOC(C=C1)=C23
InChIKey
InChIKey=AATYYTKKUTVPIK-UHFFFAOYSA-N
Formula
C14H15BrN2O
Mass
307.191
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
Benzoxazines 3-alkylindoles Azepines Aralkylamines Alkyl aryl ethers Benzenoids Aryl bromides Pyrroles Heteroaromatic compounds Oxacyclic compounds Dialkylamines Azacyclic compounds Organobromides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxazine - Pyrroloazepine - 3-alkylindole - Indole - Indole or derivatives - Alkyl aryl ether - Azepine - Aralkylamine - Aryl bromide - Aryl halide - Benzenoid - Pyrrole - Heteroaromatic compound - Oxacycle - Ether - Secondary aliphatic amine - Azacycle - Secondary amine - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Hydrocarbon derivative - Organic oxygen compound - Amine - Organic nitrogen 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