Compound Identification
SMILES
CCCCN(CCC1=CC(Cl)=C(Cl)C=C1)C[C@@H](O)COC1=CC=C(O)C=C1
InChIKey
InChIKey=MCVXYGKCJOCYJP-GOSISDBHSA-N
Formula
C21H27Cl2NO3
Mass
412.35
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenethylamines
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenethylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenethylamines
Alternative Parents
4-alkoxyphenols Phenoxy compounds Phenol ethers Dichlorobenzenes Aralkylamines Alkyl aryl ethers 1-hydroxy-2-unsubstituted benzenoids Aryl chlorides Trialkylamines Secondary alcohols 1,2-aminoalcohols Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenethylamine - 4-alkoxyphenol - 1,2-dichlorobenzene - Phenoxy compound - Phenol ether - Alkyl aryl ether - Chlorobenzene - Halobenzene - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Aralkylamine - Aryl chloride - Aryl halide - Tertiary aliphatic amine - Tertiary amine - Secondary alcohol - 1,2-aminoalcohol - Ether - Hydrocarbon derivative - Organohalogen compound - Organic nitrogen compound - Alcohol - Organochloride - Organonitrogen compound - Organooxygen compound - Amine - Organic oxygen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenethylamines. These are compounds containing a phenethylamine moiety, which consists of a phenyl group substituted at the second position by an ethan-1-amine.
External Descriptors
Not available