Compound Identification
SMILES
CCCC(=O)OC1=CC=C(C=C1)C1=C(C(=O)C2=CC=C(OCCN3CCCCC3)C=C2)C2=C(S1)C=C(OC(=O)C(Cl)(Cl)Cl)C=C2
InChIKey
InChIKey=UABITQGAEHMGCA-UHFFFAOYSA-N
Formula
C34H32Cl3NO6S
Mass
689.04
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
3-aroylthiophenes Phenol esters 1-benzothiophenes Thiophene carboxylic acids and derivatives Phenoxy compounds Phenol ethers Benzoyl derivatives Alkyl aryl ethers Fatty acid esters Piperidines Dicarboxylic acids and derivatives Heteroaromatic compounds Alpha-halocarboxylic acid derivatives Carboxylic acid esters Amino acids and derivatives Trialkylamines Azacyclic compounds Organochlorides Alkyl chlorides Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aryl-phenylketone - 3-aroylthiophene - Phenol ester - Benzothiophene - 1-benzothiophene - Benzoyl - Phenoxy compound - Phenol ether - Thiophene carboxylic acid or derivatives - Alkyl aryl ether - Fatty acid ester - Monocyclic benzene moiety - Fatty acyl - Dicarboxylic acid or derivatives - Benzenoid - Piperidine - Alpha-halocarboxylic acid derivative - Alpha-halocarboxylic acid or derivatives - Heteroaromatic compound - Thiophene - Tertiary amine - Amino acid or derivatives - Tertiary aliphatic amine - Carboxylic acid ester - Ether - Organoheterocyclic compound - Carboxylic acid derivative - Azacycle - Organochloride - Alkyl halide - Hydrocarbon derivative - Organohalogen compound - Amine - Alkyl chloride - Organonitrogen compound - Organic nitrogen compound - Organic oxide - 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