Compound Identification
SMILES
OC(=O)C(O)=O.C(CC1=CC2=C(OCO2)C=C1)NC1CCCCCC1
InChIKey
InChIKey=CXPFLVGLDGYNMH-UHFFFAOYSA-N
Formula
C18H25NO6
Mass
351.399
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
Phenethylamines Aralkylamines Dicarboxylic acids and derivatives Oxacyclic compounds Dialkylamines Carboxylic acids Acetals Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Not available
Substituents
Benzodioxole - Phenethylamine - Aralkylamine - Dicarboxylic acid or derivatives - Benzenoid - Acetal - Carboxylic acid derivative - Carboxylic acid - Secondary aliphatic amine - Secondary amine - Oxacycle - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organopnictogen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Amine - 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