Compound Identification
SMILES
COC1=CC=C(NC(C#N)C2=C(Cl)N=C3C=CC(Br)=CC3=C2)C=C1
InChIKey
InChIKey=NJIZRTMVUFVBQY-UHFFFAOYSA-N
Formula
C18H13BrClN3O
Mass
402.68
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
-
Class
Quinolines and derivatives
-
Subclass
Haloquinolines
- Level 5 Chloroquinolines
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Subclass
Haloquinolines
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Class
Quinolines and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Quinolines and derivatives
Subclass
Haloquinolines
Intermediate Tree Nodes
Not available
Direct Parent
Chloroquinolines
Alternative Parents
Methoxyanilines Aminophenyl ethers Phenylalkylamines Phenoxy compounds Methoxybenzenes Anisoles Secondary alkylarylamines 2-halopyridines Alkyl aryl ethers Aryl chlorides Aryl bromides Heteroaromatic compounds Alpha-aminonitriles Azacyclic compounds Hydrocarbon derivatives Organobromides Organochlorides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Chloroquinoline - Aminophenyl ether - Methoxyaniline - Phenol ether - Phenoxy compound - Anisole - Aniline or substituted anilines - Phenylalkylamine - Methoxybenzene - Alkyl aryl ether - Secondary aliphatic/aromatic amine - Aralkylamine - 2-halopyridine - Monocyclic benzene moiety - Aryl bromide - Pyridine - Benzenoid - Aryl chloride - Aryl halide - Heteroaromatic compound - Alpha-aminonitrile - Azacycle - Secondary amine - Ether - Carbonitrile - Nitrile - Organopnictogen compound - Organic oxygen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organohalogen compound - Organobromide - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as chloroquinolines. These are compounds containing a quinoline moiety, which carries one or more chlorine atoms.
External Descriptors
Not available