Compound Identification
SMILES
NC1=C(C#N)\C(NN1)=C(/C=C1\C=CC(=O)C(O)=C1)\C#N
InChIKey
InChIKey=SDSVPZUZQMUBAT-LDFFKZMUSA-N
Formula
C13H9N5O2
Mass
267.248
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 P-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
P-quinomethanes
Alternative Parents
Pyrazolines Ketene acetals Nitriles Enols Azacyclic compounds Organic oxides Hydrocarbon derivatives Hydrazines and derivatives Amines
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
P-quinomethane - Pyrazoline - Ketene acetal or derivatives - Azacycle - Organoheterocyclic compound - Nitrile - Carbonitrile - Enol - Hydrocarbon derivative - Cyanide - Organic nitrogen compound - Organonitrogen compound - Hydrazine derivative - Amine - Organic oxide - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as p-quinomethanes. These are organic compounds containing a benzene ring conjugated to a methylidene group and a ketone at carbon atoms 1 and 4, respectively.
External Descriptors
Not available