Compound Identification
SMILES
OC(=O)C(F)(F)F.CN1C(N)=NC2(CC(C)(C)C(F)(F)C3=C2C=C(Br)C=C3)C1=O
InChIKey
InChIKey=SFNNEPGYQWOQCW-UHFFFAOYSA-N
Formula
C17H17BrF5N3O3
Mass
486.237
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
Alpha amino acids and derivatives Aryl bromides Imidazolinones Alpha-halocarboxylic acids Guanidines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Carboximidamides Carboxylic acids Monocarboxylic acids and derivatives Carbonyl compounds Alkyl fluorides Organofluorides Amines Organic oxides Hydrocarbon derivatives Organobromides
Molecular Framework
Not available
Substituents
Alpha-amino acid or derivatives - Tetralin - Aryl bromide - Aryl halide - Imidazolinone - Alpha-halocarboxylic acid - Alpha-halocarboxylic acid or derivatives - 2-imidazoline - Guanidine - Azacycle - Carboxylic acid derivative - Carboxylic acid - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Monocarboxylic acid or derivatives - Carboximidamide - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Carbonyl group - Alkyl fluoride - Amine - Organohalogen compound - Organobromide - Organofluoride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic 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