Compound Identification
SMILES
COC1=C(OC)C=C2C(Cl)=C(C(Cl)C2=C1)C1=CC=C(Br)C=C1
InChIKey
InChIKey=ZQEDTHGOYDNZKQ-UHFFFAOYSA-N
Formula
C17H13BrCl2O2
Mass
400.09
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Indenes and isoindenes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Indenes and isoindenes
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Indenes and isoindenes
Alternative Parents
Anisoles Bromobenzenes Alkyl aryl ethers Aryl bromides Vinyl chlorides Chloroalkenes Organochlorides Organobromides Hydrocarbon derivatives Alkyl chlorides
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Indene - Anisole - Alkyl aryl ether - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Vinyl halide - Haloalkene - Ether - Chloroalkene - Vinyl chloride - Organobromide - Organohalogen compound - Alkyl halide - Alkyl chloride - Organic oxygen compound - Hydrocarbon derivative - Organochloride - Organooxygen compound - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as indenes and isoindenes. These are compounds containing an indene moiety(which consists of a cyclopentadiene fused to a benzene ring), or a isoindene moiety (which consists of a cyclopentadiene fused to cyclohexadiene ring).
External Descriptors
Not available