Compound Identification
SMILES
COC(=O)C=C(SC=C(N1CCN2C1=C(C(=O)OC)C(C(=O)OC)=C2C(=O)C1=CC=CC=C1)C1=CC=CC=C1)C(=O)OC
InChIKey
InChIKey=WQYHLUMMWFVIAJ-UHFFFAOYSA-N
Formula
C31H28N2O9S
Mass
604.63
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 Aryl-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
Aryl-phenylketones
Alternative Parents
Benzoyl derivatives Styrenes Pyrrole carboxylic acids and derivatives Fatty acid esters Vinylogous thioesters Dicarboxylic acids and derivatives Substituted pyrroles Vinylogous amides Enoate esters Heteroaromatic compounds Methyl esters Thioenol ethers Sulfenyl compounds Azacyclic compounds Enamines Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aryl-phenylketone - Styrene - Benzoyl - Pyrrole-3-carboxylic acid or derivatives - Fatty acid ester - Monocyclic benzene moiety - Substituted pyrrole - Benzenoid - Fatty acyl - Vinylogous thioester - Dicarboxylic acid or derivatives - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Pyrrole - Vinylogous amide - Heteroaromatic compound - Methyl ester - Thioenolether - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Enamine - Organoheterocyclic compound - Sulfenyl compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organonitrogen compound - Organosulfur compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as aryl-phenylketones. These are aromatic compounds containing a ketone substituted by one aryl group, and a phenyl group.
External Descriptors
Not available