Compound Identification
SMILES
CCOC(=O)C(C(=O)CS(=O)(=O)C1=CC=C(C)C=C1)=C(N)NC(=O)C1=CC=CC=C1
InChIKey
InChIKey=FSDFMVSUKRUNFW-UHFFFAOYSA-N
Formula
C21H22N2O6S
Mass
430.48
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Toluenes
- Level 5 Tosyl compounds
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Subclass
Toluenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Toluenes
Intermediate Tree Nodes
Not available
Direct Parent
Tosyl compounds
Alternative Parents
Benzamides Benzenesulfonyl compounds Benzoyl derivatives Fatty acid esters Beta-keto acids and derivatives Alpha-branched alpha,beta-unsaturated ketones Vinylogous amides Sulfones Acryloyl compounds Enones Enoate esters Secondary carboxylic acid amides Ketones Ketene acetals Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Tosyl compound - Benzamide - Benzoic acid or derivatives - Benzenesulfonyl group - Benzoyl - Fatty acid ester - Beta-keto acid - Fatty acyl - Keto acid - Alpha-branched alpha,beta-unsaturated-ketone - Acryloyl-group - Vinylogous amide - Enone - Alpha,beta-unsaturated ketone - Sulfone - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Sulfonyl - Secondary carboxylic acid amide - Ketene acetal or derivatives - Carboxylic acid ester - Carboxamide group - Ketone - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organooxygen compound - Carbonyl group - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as tosyl compounds. These are organosulfur compounds containing a tosyl group, with the general formula CH3C6H4S(O2)R (R = any atom).
External Descriptors
Not available