Compound Identification
SMILES
COC1=C(C=C(C=C1)C(=O)C[C@]1(O)C(=O)N(CC2=CC=CC=C2C)C2=C1C=C(Cl)C=C2)[N+]([O-])=O
InChIKey
InChIKey=QVYBYMSCFNGDFE-RUZDIDTESA-N
Formula
C25H21ClN2O6
Mass
480.9
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
Nitrophenyl ethers Indoles and derivatives Methoxyanilines Anisoles Aryl alkyl ketones Benzoyl derivatives Methoxybenzenes Nitroaromatic compounds Phenoxy compounds Toluenes Alkyl aryl ethers Aryl chlorides Beta-hydroxy ketones Tertiary alcohols Tertiary carboxylic acid amides Tertiary amines Amino acids and derivatives Lactams Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic zwitterions Organochlorides Organic salts Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Nitrophenyl ether - Nitrobenzene - Indole or derivatives - Methoxyaniline - Methoxybenzene - Benzoyl - Aryl alkyl ketone - Phenol ether - Anisole - Nitroaromatic compound - Phenoxy compound - Alkyl aryl ether - Toluene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Beta-hydroxy ketone - Benzenoid - Tertiary alcohol - Tertiary carboxylic acid amide - Amino acid or derivatives - Organic nitro compound - Carboxamide group - Lactam - C-nitro compound - Tertiary amine - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic salt - Organonitrogen compound - Organic nitrogen compound - Amine - Organochloride - Organic zwitterion - Hydrocarbon derivative - Alcohol - Organic oxide - Organohalogen compound - Aromatic heteropolycyclic 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