Compound Identification
SMILES
COC1=C(Cl)C=C(NC2=NC(NC3CCCCCC3)=NC(OC3=C(Cl)C=C(C=C3)C(C)=O)=N2)C=C1
InChIKey
InChIKey=FSZPMQTVOIJHQH-UHFFFAOYSA-N
Formula
C25H27Cl2N5O3
Mass
516.42
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
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Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
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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
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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
Diarylethers Acetophenones Methoxyanilines 1,3,5-triazine-2,4-diamines Phenoxy compounds Anisoles Aryl alkyl ketones Benzoyl derivatives Methoxybenzenes Chlorobenzenes Alkyl aryl ethers N-aliphatic s-triazines Aryl chlorides 1,3,5-triazines Heteroaromatic compounds Azacyclic compounds Amines Organochlorides Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - Diaryl ether - Acetophenone - Methoxyaniline - Anisole - Benzoyl - Phenoxy compound - Phenol ether - Aryl alkyl ketone - Aniline or substituted anilines - 2,4-diamine-s-triazine - Methoxybenzene - Aminotriazine - N-aliphatic s-triazine - Amino-1,3,5-triazine - Halobenzene - Chlorobenzene - Alkyl aryl ether - Benzenoid - Triazine - Aryl chloride - 1,3,5-triazine - Monocyclic benzene moiety - Aryl halide - Heteroaromatic compound - Organoheterocyclic compound - Azacycle - Ether - Organic oxide - Organic nitrogen compound - Amine - Organohalogen compound - Organochloride - Organonitrogen compound - Hydrocarbon derivative - 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