Compound Identification
SMILES
[Cu].CSC(NNC=C1C=CC=C(C([O-])=O)C1=O)=NC=C1C=CC=C(C([O-])=O)C1=O
InChIKey
InChIKey=YKOGATSHYVRDGF-UHFFFAOYSA-L
Formula
C18H13CuN3O6S
Mass
462.92
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
Dicarboxylic acids and derivatives Vinylogous amides Carboxylic acid salts Sulfenyl compounds Organic transition metal salts Carboxylic acids Organonitrogen compounds Organic oxides Hydrocarbon derivatives Organic anions
Molecular Framework
Aliphatic homomonocyclic compounds
Substituents
O-quinomethane - Dicarboxylic acid or derivatives - Vinylogous amide - Carboxylic acid salt - Organic transition metal salt - Sulfenyl compound - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organonitrogen compound - Organic anion - Aliphatic 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