Compound Identification
SMILES
COC1=C(C=C(C=C1N1CCOCC1)C(=O)CN1[N-]C(=N)[N+]2=C1C=CC(OCC1CC1)=N2)C(C)(C)C
InChIKey
InChIKey=ZEMQFZUURSNVJH-UHFFFAOYSA-N
Formula
C26H34N6O4
Mass
494.596
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
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
-
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
Phenylmorpholines Triazolopyridazines Aminophenyl ethers Methoxyanilines Phenylpropanes Anisoles Aryl alkyl ketones Benzoyl derivatives Dialkylarylamines Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Pyridazines and derivatives Heteroaromatic compounds Triazoles Dialkyl ethers Azacyclic compounds Oxacyclic compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Phenylmorpholine - Phenylpropane - Aminophenyl ether - Triazolopyridazine - Methoxyaniline - Anisole - Benzoyl - Phenol ether - Phenoxy compound - Aryl alkyl ketone - Dialkylarylamine - Aniline or substituted anilines - Methoxybenzene - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Morpholine - Oxazinane - Pyridazine - Heteroaromatic compound - Azole - 1,2,4-triazole - Tertiary amine - Ether - Organoheterocyclic compound - Dialkyl ether - Azacycle - Oxacycle - Organic salt - Organonitrogen compound - Organic oxide - Organic zwitterion - Amine - Hydrocarbon derivative - Organic nitrogen 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