Compound Identification
SMILES
[O-][N+](=O)C1=CC=CC(=C1)C(=O)COC(=O)C1CN(NC(=O)C2=CC=CC=C2Cl)C(=O)C1
InChIKey
InChIKey=HVAYCYQNNZPGAD-UHFFFAOYSA-N
Formula
C20H16ClN3O7
Mass
445.81
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
2-halobenzoic acids and derivatives Nitrobenzenes Pyrrolidine carboxylic acids Oxoprolines Aryl alkyl ketones Benzoyl derivatives Nitroaromatic compounds Alpha-acyloxy ketones Chlorobenzenes Pyrrolidine-2-ones Aryl chlorides Vinylogous halides Carboxylic acid esters Carboxylic acid hydrazides Lactams Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Organonitrogen compounds Organic salts Organic zwitterions Organochlorides Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Nitrobenzene - Benzoic acid or derivatives - Nitroaromatic compound - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine carboxylic acid - Oxoproline - Aryl alkyl ketone - Benzoyl - Alpha-acyloxy ketone - Halobenzene - Chlorobenzene - Benzenoid - Pyrrolidone - 2-pyrrolidone - Aryl halide - Aryl chloride - Monocyclic benzene moiety - Vinylogous halide - Pyrrolidine - Organic nitro compound - Carboxylic acid ester - Carboxylic acid hydrazide - Lactam - C-nitro compound - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Azacycle - Monocarboxylic acid or derivatives - Organic 1,3-dipolar compound - Carboxylic acid derivative - Organoheterocyclic compound - Organohalogen compound - Organic oxide - Organic nitrogen compound - Organic zwitterion - Organochloride - Organonitrogen compound - Hydrocarbon derivative - Organic salt - Aromatic heteromonocyclic 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