Compound Identification
SMILES
OC1=C(Cl)C=C(F)C(=C1)N=C1OC(=O)C2=C1CCCC2
InChIKey
InChIKey=HJHRMSBMHCUHFR-UHFFFAOYSA-N
Formula
C14H11ClFNO3
Mass
295.69
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
P-fluorophenols O-chlorophenols 1-hydroxy-2-unsubstituted benzenoids Chlorobenzenes Fluorobenzenes Aryl chlorides Aryl fluorides Butenolides Lactones Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isobenzofuran - 2-chlorophenol - 2-halophenol - 4-halophenol - 4-fluorophenol - 1-hydroxy-2-unsubstituted benzenoid - Halobenzene - Fluorobenzene - Phenol - Chlorobenzene - Aryl fluoride - Aryl halide - Aryl chloride - Benzenoid - 2-furanone - Monocyclic benzene moiety - Dihydrofuran - Lactone - Oxacycle - Carboxylic acid derivative - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Monocarboxylic acid or derivatives - Organooxygen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organofluoride - Organochloride - Organohalogen compound - Hydrocarbon derivative - 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