Compound Identification
SMILES
[Cl-].COC(=O)CCCCCCCCC(=O)N(O)C[C@@H]([NH3+])CC1=CC=C(OCC2=CC=CC=C2)C=C1
InChIKey
InChIKey=QWSGOEMBFNCQIL-JIDHJSLPSA-N
Formula
C27H39ClN2O5
Mass
507.07
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Phenethylamines
- Level 5 Amphetamines and derivatives
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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
Amphetamines and derivatives
Alternative Parents
Phenoxy compounds Phenol ethers Alkyl aryl ethers Aralkylamines Fatty acid methyl esters Quaternary ammonium salts Methyl esters Amino acids and derivatives Hydroxamic acids Monocarboxylic acids and derivatives Hydrocarbon derivatives Monoalkylamines Carbonyl compounds Organic chloride salts Organic oxides Organic zwitterions
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Amphetamine or derivatives - Phenoxy compound - Phenol ether - Alkyl aryl ether - Fatty acid ester - Fatty acid methyl ester - Aralkylamine - Fatty acyl - Methyl ester - Quaternary ammonium salt - Carboxylic acid ester - Amino acid or derivatives - Hydroxamic acid - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Organic oxide - Organonitrogen compound - Organooxygen compound - Primary aliphatic amine - Organic oxygen compound - Amine - Primary amine - Organic zwitterion - Organic salt - Carbonyl group - Organic nitrogen compound - Organic chloride salt - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as amphetamines and derivatives. These are organic compounds containing or derived from 1-phenylpropan-2-amine.
External Descriptors
Not available