Compound Identification
SMILES
Cl.Cl.CCCN(CCCCCCNCCC1=CC=C(C=C1)C(O)=O)[C@H]1CCC2=C(C1)C=CC(O)=C2O
InChIKey
InChIKey=KKONKTLFLYKPAS-ASMAMLKCSA-N
Formula
C28H42Cl2N2O4
Mass
541.55
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
Phenethylamines Benzoic acids Benzoyl derivatives Aralkylamines 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Trialkylamines Amino acids Dialkylamines Carboxylic acids Organooxygen compounds Organic oxides Hydrochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Tetralin - Benzoic acid or derivatives - Benzoic acid - Phenethylamine - Benzoyl - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Aralkylamine - Monocyclic benzene moiety - Tertiary aliphatic amine - Amino acid - Tertiary amine - Amino acid or derivatives - Secondary amine - Carboxylic acid derivative - Carboxylic acid - Secondary aliphatic amine - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Amine - Organic nitrogen compound - Hydrochloride - Hydrocarbon derivative - 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