Compound Identification
SMILES
COC1=C(OC)C=C(C=C1)C1=NN(CC(=O)C2=CC=C(C)C=C2)C(=O)C2=CC=CC=C12
InChIKey
InChIKey=XRCYDQYYTGFJBB-UHFFFAOYSA-N
Formula
C25H22N2O4
Mass
414.461
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
Phenylpyridazines Phthalazinones Dimethoxybenzenes Anisoles Aryl alkyl ketones Benzoyl derivatives Phenoxy compounds Toluenes Alkyl aryl ethers Pyridazinones Heteroaromatic compounds Lactams Azacyclic compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Phenylpyridazine - Phthalazinone - O-dimethoxybenzene - Dimethoxybenzene - Phthalazine - Phenoxy compound - Anisole - Benzoyl - Phenol ether - Methoxybenzene - Aryl alkyl ketone - Alkyl aryl ether - Pyridazinone - Toluene - Benzenoid - Pyridazine - Monocyclic benzene moiety - Heteroaromatic compound - Lactam - Azacycle - Ether - Organoheterocyclic compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - 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