Compound Identification
SMILES
CC(=O)C1=CC2=C(OCO2)C=C1NC(=O)CCC([O-])=O
InChIKey
InChIKey=WEOUVOPMAFJEHU-UHFFFAOYSA-M
Formula
C13H12NO6
Mass
278.241
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzodioxoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzodioxoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzodioxoles
Alternative Parents
Acetophenones Aryl alkyl ketones N-arylamides Fatty amides Vinylogous amides Secondary carboxylic acid amides Carboxylic acid salts Acetals Oxacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Organic oxides Aldehydes Hydrocarbon derivatives Organopnictogen compounds Organic anions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Acetophenone - Benzodioxole - Aryl alkyl ketone - Aryl ketone - N-arylamide - Fatty amide - Fatty acyl - Benzenoid - Vinylogous amide - Carboxamide group - Carboxylic acid salt - Ketone - Secondary carboxylic acid amide - Acetal - Carboxylic acid derivative - Carboxylic acid - Oxacycle - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Aldehyde - Organic oxide - Organic nitrogen compound - Organopnictogen compound - Carbonyl group - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic anion - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzodioxoles. These are organic compounds containing a benzene ring fused to either isomers of dioxole. Dioxole is a five-membered unsaturated ring of two oxygen atoms and three carbon atoms.
External Descriptors
Not available