Compound Identification
SMILES
[I-].CC(=O)C1=CC(OCCCCCCCCOC(=O)CC2=CC=C(C=C2)[N+](C)(C)C)=CC=C1
InChIKey
InChIKey=JGRCCYARLDHAGF-UHFFFAOYSA-M
Formula
C27H38INO4
Mass
567.508
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
-
Level 5
Ketones
-
Level 6
Aryl ketones
-
Level 7
Phenylketones
- Level 8 Alkyl-phenylketones
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Level 7
Phenylketones
-
Level 6
Aryl ketones
-
Level 5
Ketones
-
Subclass
Carbonyl compounds
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbonyl compounds
Intermediate Tree Nodes
Ketones - Aryl ketones - Phenylketones
Direct Parent
Alkyl-phenylketones
Alternative Parents
Acetophenones Phenoxy compounds Phenol ethers Benzoyl derivatives Aryl alkyl ketones Aniline and substituted anilines Alkyl aryl ethers Carboxylic acid esters Monocarboxylic acids and derivatives Organic zwitterions Organic oxides Organic iodide salts Hydrocarbon derivatives Amines
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alkyl-phenylketone - Acetophenone - Benzoyl - Phenol ether - Aryl alkyl ketone - Aniline or substituted anilines - Phenoxy compound - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Carboxylic acid ester - Monocarboxylic acid or derivatives - Ether - Carboxylic acid derivative - Organic salt - Amine - Organic zwitterion - Organonitrogen compound - Organic nitrogen compound - Organic iodide salt - Hydrocarbon derivative - Organic oxide - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.
External Descriptors
Not available