Compound Identification
SMILES
OC(=O)C(F)(F)F.OC(=O)C(F)(F)F.CCC1(CC)[C@@H]([NH3+])[C@@H](CC2=C1C=C(O)C=C2)OCCN
InChIKey
InChIKey=WVYZTJIJYBCEAW-AMTWEWDESA-O
Formula
C20H29F6N2O6
Mass
507.45
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Tetralins
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Tetralins
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Tetralins
Alternative Parents
Aralkylamines 1-hydroxy-2-unsubstituted benzenoids Quaternary ammonium salts Alpha-halocarboxylic acids Monocarboxylic acids and derivatives Dialkyl ethers Carboxylic acids Organofluorides Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides Organic cations
Molecular Framework
Not available
Substituents
Tetralin - 1-hydroxy-2-unsubstituted benzenoid - Aralkylamine - Phenol - Alpha-halocarboxylic acid - Alpha-halocarboxylic acid or derivatives - Quaternary ammonium salt - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Monocarboxylic acid or derivatives - Alkyl fluoride - Alkyl halide - Organonitrogen compound - Organofluoride - Organohalogen compound - Organooxygen compound - Primary aliphatic amine - Primary amine - Hydrocarbon derivative - Organic oxide - Carbonyl group - Amine - Organic oxygen compound - Organic nitrogen compound - Organic cation - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as tetralins. These are polycyclic aromatic compounds containing a tetralin moiety, which consists of a benzene fused to a cyclohexane.
External Descriptors
Not available