Compound Identification
SMILES
CC(=O)OC1CCCC(CCCNCCCC2=CC3=C(OCO3)C=C2Br)=C1
InChIKey
InChIKey=RRUDXWQMZZMEIO-UHFFFAOYSA-N
Formula
C21H28BrNO4
Mass
438.362
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzodioxoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzodioxoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzodioxoles
Alternative Parents
Aralkylamines Benzenoids Aryl bromides Carboxylic acid esters Amino acids and derivatives Oxacyclic compounds Monocarboxylic acids and derivatives Dialkylamines Acetals Organopnictogen compounds Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodioxole - Aralkylamine - Aryl bromide - Aryl halide - Benzenoid - Amino acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Oxacycle - Secondary aliphatic amine - Monocarboxylic acid or derivatives - Secondary amine - Acetal - Organopnictogen compound - Amine - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzodioxoles. These are organic compounds containing a benzene ring fused to either isomers of dioxole. Dioxole is a five-membered unsaturated ring of two oxygen atoms and three carbon atoms.
External Descriptors
Not available