Compound Identification
SMILES
CC1=C2C(=O)OC(C3=COC=C3)[C@]2(C)CCC1
InChIKey
InChIKey=XYYAFLHHHZVPRN-TYZXPVIJSA-N
Formula
C14H16O3
Mass
232.279
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Isobenzofurans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Isobenzofurans
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Isobenzofurans
Alternative Parents
Gamma butyrolactones Oxolanes Heteroaromatic compounds Furans Enoate esters Oxacyclic compounds Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isobenzofuran - Gamma butyrolactone - Furan - Oxolane - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Heteroaromatic compound - Lactone - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Oxacycle - Carbonyl group - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as isobenzofurans. These are organic aromatic compounds containing an isobenzofuran moiety.
External Descriptors
Not available