Compound Identification
SMILES
NCC(NN1CC2=CC=CC=C2C(CNC2CCCCC2)C1C(=O)C1=C(Cl)C=CC(=C1)[N+]([O-])=O)C(O)=O
InChIKey
InChIKey=ALNYQLBFGKMIAH-UHFFFAOYSA-N
Formula
C26H32ClN5O5
Mass
530.02
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
Tetrahydroisoquinolines Alpha amino acids and derivatives Nitrobenzenes Aryl alkyl ketones Benzoyl derivatives Nitroaromatic compounds Aralkylamines Chlorobenzenes Cyclohexylamines Aryl chlorides Gamma-amino ketones Vinylogous halides Amino acids Alkylhydrazines Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Azacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Dialkylamines Organic oxides Organic salts Organochlorides Monoalkylamines Organic zwitterions Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Alpha-amino acid or derivatives - Tetrahydroisoquinoline - Nitrobenzene - Nitroaromatic compound - Benzoyl - Aryl alkyl ketone - Chlorobenzene - Cyclohexylamine - Aralkylamine - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Gamma-aminoketone - Benzenoid - Vinylogous halide - Amino acid or derivatives - Amino acid - C-nitro compound - Organic nitro compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Secondary amine - Alkylhydrazine - Organic oxoazanium - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Azacycle - Secondary aliphatic amine - Organoheterocyclic compound - Organic zwitterion - Organic nitrogen compound - Hydrazine derivative - Primary aliphatic amine - Organic salt - Organohalogen compound - Hydrocarbon derivative - Organochloride - Organic oxide - Organonitrogen compound - Primary amine - Amine - 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