Compound Identification
SMILES
COC1=NC=C(C=C2OC(=O)C3=CC=CC=C23)C(OC)=N1
InChIKey
InChIKey=CMNMPKRDOUHXQU-UHFFFAOYSA-N
Formula
C15H12N2O4
Mass
284.271
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Isocoumarans
- Subclass Isobenzofuranones
-
Class
Isocoumarans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Isocoumarans
Subclass
Isobenzofuranones
Intermediate Tree Nodes
Not available
Direct Parent
Isobenzofuranones
Alternative Parents
Alkyl aryl ethers Pyrimidines and pyrimidine derivatives Benzenoids Heteroaromatic compounds Enol esters Lactones Oxacyclic compounds Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isobenzofuranone - Alkyl aryl ether - Pyrimidine - Benzenoid - Enol ester - Heteroaromatic compound - Lactone - Carboxylic acid ester - Oxacycle - Azacycle - Ether - Carboxylic acid derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as isobenzofuranones. These are compounds containing a 2-benzofuran moiety that carries an oxo group at the 1 position.
External Descriptors
Not available