Compound Identification
SMILES
COC1=CC=C(CN(C)CCC2=CC=C(C=C2)C2=NN3C(C2)C2=CC=CC=C2OC3C(=O)C2=CC=C(C=C2)C#N)C=C1
InChIKey
InChIKey=UTACDPTXICMKTD-UHFFFAOYSA-N
Formula
C35H32N4O3
Mass
556.666
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
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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
Benzoxazines Phenethylamines Anisoles Aryl alkyl ketones Benzonitriles Benzoyl derivatives Benzylamines Methoxybenzenes Phenoxy compounds Phenylmethylamines Aralkylamines Alkyl aryl ethers Pyrazolines Trialkylamines Hydrazones Azacyclic compounds Nitriles Oxacyclic compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Benzoxazine - Phenethylamine - Anisole - Benzonitrile - Benzoyl - Benzylamine - Phenoxy compound - Phenol ether - Phenylmethylamine - Aryl alkyl ketone - Methoxybenzene - Aralkylamine - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Pyrazoline - Tertiary aliphatic amine - Tertiary amine - Oxacycle - Azacycle - Nitrile - Carbonitrile - Hydrazone - Ether - Organoheterocyclic compound - Organic oxide - Organonitrogen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Cyanide - 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