Compound Identification
SMILES
CC(OC(=O)C1=CC=C(NS(=O)(=O)C2=CC(F)=C(F)C=C2)C=C1)C(=O)NC1=NC(=CS1)C1=CC(=CC=C1)[N+]([O-])=O
InChIKey
InChIKey=YZZYWZPVTGTZML-UHFFFAOYSA-N
Formula
C25H18F2N4O7S2
Mass
588.56
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Benzoic acids and derivatives
- Level 5 Benzoic acid esters
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Subclass
Benzoic acids and derivatives
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Class
Benzene and substituted derivatives
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Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Benzoic acid esters
Alternative Parents
Sulfanilides Benzenesulfonamides Benzenesulfonyl compounds Nitrobenzenes Benzoyl derivatives N-arylamides Nitroaromatic compounds 2,4-disubstituted thiazoles Fluorobenzenes Organosulfonamides Aryl fluorides Aminosulfonyl compounds Heteroaromatic compounds Secondary carboxylic acid amides Carboxylic acid esters Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic zwitterions Carbonyl compounds Organofluorides Organic salts Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Sulfanilide - Benzoate ester - Benzenesulfonamide - Nitrobenzene - Benzenesulfonyl group - N-arylamide - Nitroaromatic compound - Benzoyl - 2,4-disubstituted 1,3-thiazole - Halobenzene - Fluorobenzene - Organosulfonic acid amide - Aryl halide - Aryl fluoride - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Aminosulfonyl compound - Thiazole - Sulfonyl - Azole - Heteroaromatic compound - Organic nitro compound - Carboxamide group - Carboxylic acid ester - C-nitro compound - Secondary carboxylic acid amide - Allyl-type 1,3-dipolar organic compound - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic salt - Organic oxygen compound - Organosulfur compound - Carbonyl group - Hydrocarbon derivative - Organooxygen compound - Organic oxide - Organic zwitterion - Organohalogen compound - Organic nitrogen compound - Organofluoride - Organonitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid.
External Descriptors
Not available