Compound Identification
SMILES
CC(=O)[C@@H]1[C@@H](C2=CC=C(Br)C=C2)C(C#N)(C#N)[C@H]2C=CC3=CC=CC=C3N12
InChIKey
InChIKey=OUUSWJFCCBCRBM-NJDAHSKKSA-N
Formula
C22H16BrN3O
Mass
418.294
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Quinolines and derivatives
- Subclass Pyrroloquinolines
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Class
Quinolines and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Quinolines and derivatives
Subclass
Pyrroloquinolines
Intermediate Tree Nodes
Not available
Direct Parent
Pyrroloquinolines
Alternative Parents
Phenylpyrrolidines Hydroquinolones Hydroquinolines Dialkylarylamines Bromobenzenes Aralkylamines Aryl bromides Pyrroles Alpha-amino ketones Nitriles Azacyclic compounds Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrroloquinoline - Dihydroquinolone - 3-phenylpyrrolidine - Dihydroquinoline - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Bromobenzene - Halobenzene - Aralkylamine - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyrrole - Alpha-aminoketone - Pyrrolidine - Tertiary amine - Ketone - Azacycle - Nitrile - Carbonitrile - Hydrocarbon derivative - Organohalogen compound - Organic oxide - Cyanide - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Amine - Organobromide - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrroloquinolines. These are compounds containing a pyrroloquinoline moiety, which consists of a pyrrole ring fused to a quinoline.
External Descriptors
Not available