Compound Identification
SMILES
COC1=CC=C(NC2=CC=C(NC(=O)CC(=O)C3=CC=C(NC4=NC(=NC(=N4)N4CCCC(O)C4)N4CCCCC4)C=C3)C=C2)C=C1
InChIKey
InChIKey=AHARFKVOCJKYRK-UHFFFAOYSA-N
Formula
C35H40N8O4
Mass
636.757
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic oxygen compounds
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Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
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Level 5
Ketones
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Level 6
Aryl ketones
-
Level 7
Phenylketones
- Level 8 Alkyl-phenylketones
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Level 7
Phenylketones
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Level 6
Aryl ketones
-
Level 5
Ketones
-
Subclass
Carbonyl compounds
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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
Aminophenyl ethers Anilides Methoxyanilines Anisoles Phenoxy compounds Aryl alkyl ketones N-arylamides Methoxybenzenes Benzoyl derivatives Dialkylarylamines Alkyl aryl ethers Aminotriazines 1,3,5-triazines 1,3-dicarbonyl compounds Primary aromatic amines Piperidines Fatty amides Heteroaromatic compounds Amino acids and derivatives Secondary carboxylic acid amides Secondary alcohols Azacyclic compounds Secondary amines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - Aminophenyl ether - Methoxyaniline - Anilide - Phenoxy compound - Anisole - Benzoyl - Methoxybenzene - Phenol ether - Aniline or substituted anilines - N-arylamide - Dialkylarylamine - Aryl alkyl ketone - Alkyl aryl ether - Amino-1,3,5-triazine - Aminotriazine - Monocyclic benzene moiety - Fatty amide - 1,3,5-triazine - Piperidine - Primary aromatic amine - Triazine - Fatty acyl - 1,3-dicarbonyl compound - Benzenoid - Heteroaromatic compound - Amino acid or derivatives - Secondary carboxylic acid amide - Carboxamide group - Secondary alcohol - Organoheterocyclic compound - Ether - Carboxylic acid derivative - Azacycle - Secondary amine - Amine - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Alcohol - 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