Compound Identification
SMILES
CCOC(=O)C=CC(=O)OCC(=O)C1=CC=C(Cl)S1
InChIKey
InChIKey=GEAMFMCDHHOSMJ-UHFFFAOYSA-N
Formula
C12H11ClO5S
Mass
302.73
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 Aryl alkyl ketones
-
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
Direct Parent
Aryl alkyl ketones
Alternative Parents
Fatty acid esters Alpha-acyloxy ketones 2,5-disubstituted thiophenes Dicarboxylic acids and derivatives Aryl chlorides Heteroaromatic compounds Enoate esters Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aryl alkyl ketone - Fatty acid ester - 2,5-disubstituted thiophene - Alpha-acyloxy ketone - Aryl chloride - Aryl halide - Dicarboxylic acid or derivatives - Fatty acyl - Enoate ester - Thiophene - Alpha,beta-unsaturated carboxylic ester - Heteroaromatic compound - Carboxylic acid ester - Carboxylic acid derivative - Organoheterocyclic compound - Hydrocarbon derivative - Organochloride - Organohalogen compound - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as aryl alkyl ketones. These are ketones have the generic structure RC(=O)R', where R = aryl group and R'=alkyl group.
External Descriptors
Not available