Compound Identification
SMILES
[Zn].COC1=CC=C\C(=C\NC2=C(N\C=C3\C=CC=C(OC)C3=O)N=CC=C2)C1=O
InChIKey
InChIKey=CMSDZAYNQNRBDZ-NMMHYEMXSA-N
Formula
C21H19N3O4Zn
Mass
442.78
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
-
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
Aminopyridines and derivatives Imidolactams Vinylogous amides Heteroaromatic compounds Organic transition metal salts Enamines Azacyclic compounds Allylamines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
O-quinomethane - Aminopyridine - Pyridine - Imidolactam - Vinylogous amide - Heteroaromatic compound - Organic transition metal salt - Organoheterocyclic compound - Allylamine - Enamine - Azacycle - Amine - Hydrocarbon derivative - Organonitrogen compound - Organic oxide - 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