Compound Identification
SMILES
O=C(C1OC2=CC=CC=C2C2CC(=NN12)C1=CC=C(CCNCC2=CC=CC=C2)C=C1)C1=CC=C(C=C1)C#N
InChIKey
InChIKey=GCILGFVYYHFCRO-UHFFFAOYSA-N
Formula
C33H28N4O2
Mass
512.613
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
Benzoxazines Phenethylamines Phenylmethylamines Aryl alkyl ketones Benzonitriles Benzoyl derivatives Benzylamines Aralkylamines Pyrazolines Oxacyclic compounds Azacyclic compounds Dialkylamines Hydrazones Nitriles Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Benzoxazine - Phenethylamine - Benzonitrile - Benzoyl - Benzylamine - Phenylmethylamine - Aryl alkyl ketone - Aralkylamine - Monocyclic benzene moiety - Benzenoid - Pyrazoline - Oxacycle - Azacycle - Organoheterocyclic compound - Secondary aliphatic amine - Hydrazone - Carbonitrile - Nitrile - Secondary amine - Organic oxide - Organic nitrogen compound - Organonitrogen compound - Cyanide - Amine - Hydrocarbon derivative - 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