Compound Identification
SMILES
CC(C)OC1=CC=C(C=C1)C(=O)OCCOC(=O)C1=C(C)NC2=C(C1C1=C(F)C=CC=C1Cl)S(=O)(=O)CCS(=O)(=O)C2
InChIKey
InChIKey=ROJUHADFTCHRTQ-UHFFFAOYSA-N
Formula
C28H29ClFNO9S2
Mass
642.11
Taxonomic Classification
Taxonomy Tree
-
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
-
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
Phenoxy compounds Phenol ethers Benzoyl derivatives Alkyl aryl ethers Fluorobenzenes Dihydropyridines Chlorobenzenes Aryl chlorides Aryl fluorides Vinylogous amides Sulfones Enoate esters Monocarboxylic acids and derivatives Azacyclic compounds Enamines Dialkylamines Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoate ester - Phenoxy compound - Benzoyl - Phenol ether - Alkyl aryl ether - Halobenzene - Fluorobenzene - Dihydropyridine - Chlorobenzene - Aryl chloride - Aryl fluoride - Aryl halide - Vinylogous amide - Sulfone - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Secondary aliphatic amine - Enamine - Ether - Monocarboxylic acid or derivatives - Organonitrogen compound - Organooxygen compound - Carbonyl group - Amine - Organic oxygen compound - Organofluoride - Organic oxide - Hydrocarbon derivative - Organochloride - Organohalogen compound - Organic nitrogen compound - Aromatic heteropolycyclic 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