Compound Identification
SMILES
CC(C)(C)[C@@H]1CN(CCC2=C1C(Cl)=NC(Cl)=N2)C(O)=O
InChIKey
InChIKey=FQCTZVHUMRZSPO-SSDOTTSWSA-N
Formula
C13H17Cl2N3O2
Mass
318.2
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Azepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azepines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Azepines
Alternative Parents
2-halopyrimidines Aryl chlorides Heteroaromatic compounds Carbamic acids Azacyclic compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-halopyrimidine - Azepine - Halopyrimidine - Aryl chloride - Aryl halide - Pyrimidine - Heteroaromatic compound - Carbamic acid - Carbamic acid derivative - Azacycle - Organic nitrogen compound - Organochloride - Organohalogen compound - Organonitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as azepines. These are organic compounds containing an unsaturated seven-member heterocycle with one nitrogen atom replacing a carbon atom.
External Descriptors
Not available