Compound Identification
SMILES
ClC1=CC2=C(OCC(=O)CC2=O)C=C1
InChIKey
InChIKey=ZMDKHKWFATYSAM-UHFFFAOYSA-N
Formula
C10H7ClO3
Mass
210.61
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzoxepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzoxepines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzoxepines
Alternative Parents
Aryl alkyl ketones Beta-diketones Alkyl aryl ethers Benzenoids Aryl chlorides Cyclic ketones Oxacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxepine - Aryl alkyl ketone - Aryl ketone - Alkyl aryl ether - 1,3-diketone - Aryl chloride - Aryl halide - Benzenoid - 1,3-dicarbonyl compound - Cyclic ketone - Ketone - Oxacycle - Ether - Organic oxygen compound - Organohalogen compound - Organochloride - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzoxepines. These are organic compounds containing a benzene ring fused to an oxepine ring (an unsaturated seven-membered heterocycle with one oxygen atom replacing a carbon atom).
External Descriptors
Not available