Compound Identification
SMILES
CN1CCN(CC1)N\C=C1\C=C(Br)C=C(Br)C1=O
InChIKey
InChIKey=WICOYURTMPZVPA-HJWRWDBZSA-N
Formula
C12H15Br2N3O
Mass
377.08
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
-
Level 5
Ketones
-
Level 6
Cyclic ketones
-
Level 7
Quinomethanes
- Level 8 O-quinomethanes
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Level 7
Quinomethanes
-
Level 6
Cyclic ketones
-
Level 5
Ketones
-
Subclass
Carbonyl compounds
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbonyl compounds
Intermediate Tree Nodes
Ketones - Cyclic ketones - Quinomethanes
Direct Parent
O-quinomethanes
Alternative Parents
N-methylpiperazines Vinylogous amides Alpha-haloketones Trialkylamines Vinyl bromides Bromoalkenes Azacyclic compounds Alkylhydrazines Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
O-quinomethane - N-methylpiperazine - N-alkylpiperazine - 1,4-diazinane - Piperazine - Alpha-haloketone - Vinylogous amide - Tertiary amine - Tertiary aliphatic amine - Alkylhydrazine - Azacycle - Vinyl bromide - Vinyl halide - Bromoalkene - Haloalkene - Organoheterocyclic compound - Organic oxide - Organonitrogen compound - Hydrocarbon derivative - Amine - Organic nitrogen compound - Hydrazine derivative - Organohalogen compound - Organobromide - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as o-quinomethanes. These are organic compounds containing a benzene ring conjugated to a methylidene group and a ketone at carbon atoms 1 and 2, respectively.
External Descriptors
Not available