Compound Identification
SMILES
OC(=O)C=CC(O)=O.OC(=O)C=CC(O)=O.O=C(CCN1C(CN2CCN(CC=CC3=CC=CC=C3)CC2)=NC2=CC=CC=C12)C1=CC=CC=C1
InChIKey
InChIKey=HQQKMIFTIIWMIQ-UHFFFAOYSA-N
Formula
C38H40N4O9
Mass
696.757
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
-
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
Benzimidazoles Styrenes Aryl alkyl ketones Benzoyl derivatives Aralkylamines N-alkylpiperazines Unsaturated fatty acids N-substituted imidazoles Dicarboxylic acids and derivatives Heteroaromatic compounds Trialkylamines Carboxylic acids Azacyclic compounds Hydrocarbon derivatives Organic oxides Organopnictogen compounds Aldehydes
Molecular Framework
Not available
Substituents
Alkyl-phenylketone - Benzimidazole - Styrene - Benzoyl - Aryl alkyl ketone - N-alkylpiperazine - Aralkylamine - Piperazine - N-substituted imidazole - Unsaturated fatty acid - Fatty acyl - Fatty acid - 1,4-diazinane - Dicarboxylic acid or derivatives - Benzenoid - Monocyclic benzene moiety - Azole - Heteroaromatic compound - Imidazole - Tertiary aliphatic amine - Tertiary amine - Organoheterocyclic compound - Azacycle - Carboxylic acid - Carboxylic acid derivative - Aldehyde - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic nitrogen compound - Amine - Organonitrogen 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