Compound Identification
SMILES
ICC(=O)OCC(=O)C1=CC=C(C=C1)N=[N+]=[N-]
InChIKey
InChIKey=KFOBGUYMRXWXFU-UHFFFAOYSA-N
Formula
C10H8IN3O3
Mass
345.096
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
Phenylazides Benzoyl derivatives Aryl alkyl ketones Alpha-acyloxy ketones Alpha-halocarboxylic acid derivatives Carboxylic acid esters Azo imides Azo compounds Monocarboxylic acids and derivatives Organopnictogen compounds Organoiodides Organic zwitterions Organic oxides Hydrocarbon derivatives Alkyl iodides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alkyl-phenylketone - Benzoyl - Aryl alkyl ketone - Phenylazide - Alpha-acyloxy ketone - Monocyclic benzene moiety - Benzenoid - Alpha-halocarboxylic acid derivative - Alpha-halocarboxylic acid or derivatives - Azo compound - Azo imide - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Alkyl iodide - Alkyl halide - Organopnictogen compound - Organoiodide - Organonitrogen compound - Organic zwitterion - 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