Compound Identification
SMILES
CCC1=NC2=CC=CC=C2C(C(=O)OCCOC2=C(Cl)C=C(Cl)C=C2)=C1C
InChIKey
InChIKey=YXSLUBJXXJLAIR-UHFFFAOYSA-N
Formula
C21H19Cl2NO3
Mass
404.29
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Quinolines and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Quinolines and derivatives
Alternative Parents
Pyridinecarboxylic acids Phenoxy compounds Phenol ethers Dichlorobenzenes Methylpyridines Alkyl aryl ethers Aryl chlorides Heteroaromatic compounds Carboxylic acid esters Azacyclic compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinoline - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - 1,3-dichlorobenzene - Phenoxy compound - Phenol ether - Halobenzene - Alkyl aryl ether - Chlorobenzene - Methylpyridine - Pyridine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Ether - Organonitrogen compound - Organooxygen compound - 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 quinolines and derivatives. These are compounds containing a quinoline moiety, which consists of a benzene ring fused to a pyrimidine ring to form benzo[b]azabenzene.
External Descriptors
Not available