Compound Identification
SMILES
[Li+].COC1=CC2=C(C=C1)[C@H]([C@@H](CN(C)CC([O-])=O)CC2)C1=CC(F)=C(F)C=C1
InChIKey
InChIKey=VNGDPHXAHBVRHV-WSZABJOTSA-M
Formula
C21H22F2LiNO3
Mass
381.35
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 Anisoles Alkyl aryl ethers Aralkylamines Fluorobenzenes Aryl fluorides Amino acids Carboxylic acid salts Trialkylamines Organic lithium salts Monocarboxylic acids and derivatives Carboxylic acids Organic metal halides Hydrocarbon derivatives Carbonyl compounds Organofluorides Organic oxides Organic zwitterions
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Alpha-amino acid - Alpha-amino acid or derivatives - Tetralin - Phenol ether - Anisole - Alkyl aryl ether - Fluorobenzene - Halobenzene - Aralkylamine - Monocyclic benzene moiety - Aryl halide - Aryl fluoride - Carboxylic acid salt - Amino acid - Amino acid or derivatives - Tertiary amine - Tertiary aliphatic amine - Carboxylic acid derivative - Carboxylic acid - Ether - Organic metal halide - Organic alkali metal salt - Organic lithium salt - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organohalogen compound - Organofluoride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic zwitterion - Organic salt - Hydrocarbon derivative - Amine - Organic oxide - Organic oxygen compound - 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