Compound Identification
SMILES
CCOC(=O)C(=C/N1C(=S)S\C(=C/C2=CC(=CC=C2)[NH+](O)[O-])C1=O)\C(=O)C1=CC=CC=C1
InChIKey
InChIKey=KDUGPAOCXGATQK-LTSGFECQSA-N
Formula
C22H18N2O6S2
Mass
470.51
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzoyl derivatives
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoyl derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Benzoyl derivatives
Alternative Parents
Aryl ketones Beta-keto acids and derivatives Fatty acid esters Thiazolidinethiones Alpha-branched alpha,beta-unsaturated ketones Acryloyl compounds Cyclic dithiocarbamic acid esters Enones Enoate esters Azacyclic compounds N-organohydroxylamines Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Organopnictogen compounds Organosulfur compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzoyl - Aryl ketone - Beta-keto acid - Fatty acid ester - Keto acid - Thiazolidinethione - Alpha-branched alpha,beta-unsaturated-ketone - Fatty acyl - Dithiocarbamic acid ester - Cyclic dithiocarbamic acid ester - Enone - Acryloyl-group - Thiazolidine - Alpha,beta-unsaturated ketone - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Carboxylic acid ester - Ketone - Azacycle - N-organohydroxylamine - Carboxylic acid derivative - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organopnictogen compound - Organonitrogen compound - Hydrocarbon derivative - Organic salt - Organic oxygen compound - Organooxygen compound - Organic oxide - Organosulfur compound - Carbonyl group - Organic nitrogen compound - Organic zwitterion - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzoyl derivatives. These are organic compounds containing an acyl moiety of benzoic acid with the formula (C6H5CO-).
External Descriptors
Not available