Compound Identification
SMILES
CCC1=CC=CC(CC)=C1N\C=C1\C=C(Br)C=C(Br)C1=O
InChIKey
InChIKey=FVOSIHQJDQYJLO-RAXLEYEMSA-N
Formula
C17H17Br2NO
Mass
411.137
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
Aniline and substituted anilines Vinylogous amides Alpha-haloketones Vinyl bromides Enamines Bromoalkenes Allylamines Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
O-quinomethane - Aniline or substituted anilines - Monocyclic benzene moiety - Benzenoid - Alpha-haloketone - Vinylogous amide - Enamine - Allylamine - Bromoalkene - Haloalkene - Vinyl halide - Vinyl bromide - Amine - Organonitrogen compound - Organobromide - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Aromatic homomonocyclic 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