Compound Identification
SMILES
COC(=O)C(CC1=CC=CC=C1I)C1=CCC2(CC1)OCCO2
InChIKey
InChIKey=WWSDPLYIMKUEOL-UHFFFAOYSA-N
Formula
C18H21IO4
Mass
428.266
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Halobenzenes
- Level 5 Iodobenzenes
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Subclass
Halobenzenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Halobenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Iodobenzenes
Alternative Parents
Ketals Fatty acid esters Aryl iodides Methyl esters 1,3-dioxolanes Oxacyclic compounds Monocarboxylic acids and derivatives Organoiodides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Ketal - Iodobenzene - Fatty acid ester - Aryl halide - Fatty acyl - Aryl iodide - Meta-dioxolane - Methyl ester - Carboxylic acid ester - Acetal - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic oxygen compound - Organohalogen compound - Organoiodide - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as iodobenzenes. These are aromatic compounds containing one or more iodine atoms attached to a benzene.
External Descriptors
Not available