Compound Identification
SMILES
OC(=O)C1C2CC2CN1S(=O)(=O)C1=CC=C(Br)C=C1
InChIKey
InChIKey=UWSISCWAFROVHI-UHFFFAOYSA-N
Formula
C12H12BrNO4S
Mass
346.2
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbohydrates and carbohydrate conjugates
- Level 5 Sugar acids and derivatives
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Subclass
Carbohydrates and carbohydrate conjugates
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbohydrates and carbohydrate conjugates
Intermediate Tree Nodes
Sugar acids and derivatives - Sugar amino acids and derivatives
Direct Parent
Bicyclic amino acids and derivatives
Alternative Parents
Alpha amino acids and derivatives Benzenesulfonamides Piperidinecarboxylic acids Benzenesulfonyl compounds Pyrrolidine carboxylic acids Bromobenzenes Organosulfonamides Aryl bromides Sulfonyls Azacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Carbonyl compounds Hydrocarbon derivatives Organic oxides Organobromides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Bicyclic amino acid - Alpha-amino acid or derivatives - Benzenesulfonamide - Benzenesulfonyl group - Piperidinecarboxylic acid - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine carboxylic acid - Halobenzene - Bromobenzene - Aryl bromide - Aryl halide - Benzenoid - Organosulfonic acid amide - Monocyclic benzene moiety - Piperidine - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Pyrrolidine - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Azacycle - Monocarboxylic acid or derivatives - Organic nitrogen compound - Carbonyl group - Organohalogen compound - Organobromide - Organonitrogen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as bicyclic amino acids and derivatives. These are sugar amino acids in which the amino acid is attached to or partly borne within a bicyclic ring system.
External Descriptors
Not available