Compound Identification
SMILES
OC(=O)CCCC1=C(Br)C2=C(CC=C2)C=C1
InChIKey
InChIKey=ILBDKLMYSBCVRZ-UHFFFAOYSA-N
Formula
C13H13BrO2
Mass
281.149
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
Aryl bromides Monocarboxylic acids and derivatives Carboxylic acids Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Indene - Aryl halide - Aryl bromide - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organobromide - Organohalogen compound - Carbonyl group - 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