Compound Identification
SMILES
O=C1C=CC=C\C1=C1\N=C(NN1C1=CC=CC=C1)\C=C\C1=CC=CC=N1
InChIKey
InChIKey=WXPLORLHAYGHKV-OQIURNAJSA-N
Formula
C21H16N4O
Mass
340.386
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
Pyridines and derivatives Imidolactams Benzene and substituted derivatives Vinylogous amides Triazolines Heteroaromatic compounds Ketene acetals Amidrazones Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Amidines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
O-quinomethane - Monocyclic benzene moiety - Pyridine - Benzenoid - Imidolactam - Triazoline - Heteroaromatic compound - Vinylogous amide - Carboxylic acid amidrazone - Ketene acetal or derivatives - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Amidine - Organoheterocyclic compound - Azacycle - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organic nitrogen compound - Aromatic 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