Compound Identification
SMILES
CC1(C)CC(=O)C(OC2=NC=C(Br)C=C2)=C1C1=CC=C(C=C1)S(C)(=O)=O
InChIKey
InChIKey=UIOKOIQPHDRAFD-UHFFFAOYSA-N
Formula
C19H18BrNO4S
Mass
436.32
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzenesulfonyl compounds
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzenesulfonyl compounds
Intermediate Tree Nodes
Not available
Direct Parent
Benzenesulfonyl compounds
Alternative Parents
Pyridines and derivatives Aryl bromides Sulfones Heteroaromatic compounds Cyclic ketones Azacyclic compounds Organonitrogen compounds Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzenesulfonyl group - Aryl bromide - Aryl halide - Pyridine - Sulfone - Sulfonyl - Heteroaromatic compound - Cyclic ketone - Ketone - Organoheterocyclic compound - Azacycle - Organic nitrogen compound - Organic oxide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzenesulfonyl compounds. These are aromatic compounds containing a benzenesulfonyl group, which consists of a monocyclic benzene moiety that carries a sulfonyl group.
External Descriptors
Not available