Compound Identification
SMILES
CC1=CC(C=C2OC(=O)C3=CC=CC=C23)=CC(C)=C1O
InChIKey
InChIKey=ANSOBNWAUKQYFV-UHFFFAOYSA-N
Formula
C17H14O3
Mass
266.296
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
m-Xylenes Ortho cresols Enol esters Lactones Oxacyclic compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isobenzofuranone - O-cresol - Xylene - M-xylene - Phenol - Benzenoid - Monocyclic benzene moiety - Enol ester - Lactone - Carboxylic acid ester - Oxacycle - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organic oxide - 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