Compound Identification
SMILES
COC1OC2COC(OC2C(OS(=O)(=O)C2=CC=C(Br)C=C2)C1OS(=O)(=O)C1=CC=C(Br)C=C1)C1=CC=CC=C1
InChIKey
InChIKey=RNFGBTHQHMLTGH-UHFFFAOYSA-N
Formula
C26H24Br2O10S2
Mass
720.4
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
Benzenesulfonic acids and derivatives
- Level 5 Benzenesulfonate esters
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Subclass
Benzenesulfonic acids and derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzenesulfonic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Benzenesulfonate esters
Alternative Parents
Pyranodioxins Benzenesulfonyl compounds Arylsulfonic acids and derivatives Bromobenzenes Oxanes Organosulfonic acid esters Monosaccharides Aryl bromides 1,3-dioxanes Sulfonyls Oxacyclic compounds Acetals Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzenesulfonate ester - Pyranodioxin - Benzenesulfonyl group - Arylsulfonic acid or derivatives - Halobenzene - Bromobenzene - Organosulfonic acid ester - Oxane - Monosaccharide - Aryl halide - Aryl bromide - Meta-dioxane - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Oxacycle - Organoheterocyclic compound - Acetal - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organobromide - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzenesulfonate esters. These are arenesulfonate esters that result from the formal condensation of the hydroxy group of an alcohol, enol, phenol or heteroarenol with benzenesulfonic acid.
External Descriptors
Not available