Compound Identification
SMILES
Cl.CN(C[C@H]1CCC2=C(C=CC(=C2)C#N)[C@H]1C1=CC=CC=C1)CC(O)=O
InChIKey
InChIKey=AJKWYEIPBLFQBV-WKOQGQMTSA-N
Formula
C21H23ClN2O2
Mass
370.88
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 Aralkylamines Benzene and substituted derivatives Trialkylamines Amino acids Nitriles Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrochlorides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Alpha-amino acid - Alpha-amino acid or derivatives - Tetralin - Aralkylamine - Monocyclic benzene moiety - Amino acid or derivatives - Amino acid - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrochloride - Hydrocarbon derivative - Carbonyl group - Organic oxide - Cyanide - Amine - 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