Compound Identification
SMILES
COC1=CC2=C(CC[C@@H]3[C@@H](N(N=C23)C(=O)CO)C2=CC(F)=C(OC(F)(F)F)C=C2)C=C1
InChIKey
InChIKey=RPGVJSZQQKMKSB-XOBRGWDASA-N
Formula
C21H18F4N2O4
Mass
438.379
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
Phenoxy compounds Anisoles Alkyl aryl ethers Fluorobenzenes Aryl fluorides Pyrazolines Trihalomethanes Azacyclic compounds Carboxylic acids and derivatives Alkyl fluorides Carbonyl compounds Primary alcohols Organofluorides Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Tetralin - Phenoxy compound - Anisole - Phenol ether - Alkyl aryl ether - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Pyrazoline - Trihalomethane - Carboxylic acid derivative - Ether - Azacycle - Organoheterocyclic compound - Organohalogen compound - Alkyl halide - Alkyl fluoride - Organic nitrogen compound - Alcohol - Carbonyl group - Hydrocarbon derivative - Halomethane - Organic oxide - Organic oxygen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Primary alcohol - 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