Compound Identification
SMILES
OC(=O)\C=C\C(O)=O.NC(CC=C)CC1=CC=CC=C1C1=NOC2=CC=CC=C12
InChIKey
InChIKey=JOBYVNUWUIRSPY-WLHGVMLRSA-N
Formula
C22H22N2O5
Mass
394.427
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
Benzisoxazoles Aralkylamines Unsaturated fatty acids Dicarboxylic acids and derivatives Isoxazoles Heteroaromatic compounds Oxacyclic compounds Carboxylic acids Azacyclic compounds Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Not available
Substituents
Amphetamine or derivatives - Benzisoxazole - Aralkylamine - Dicarboxylic acid or derivatives - Unsaturated fatty acid - Fatty acyl - Fatty acid - Azole - Heteroaromatic compound - Isoxazole - Carboxylic acid derivative - Carboxylic acid - Oxacycle - Azacycle - Organoheterocyclic compound - Primary aliphatic amine - Hydrocarbon derivative - Organic nitrogen compound - Amine - Carbonyl group - Organonitrogen compound - Organooxygen compound - Primary amine - Organic oxygen compound - Organic oxide - Aromatic heteropolycyclic 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