Compound Identification
SMILES
CCOCCOC1=CC=C(C[C@@H](C)NCCC2=NC(Br)=CC=C2)C=C1
InChIKey
InChIKey=LLACSICXRGSDLE-MRXNPFEDSA-N
Formula
C20H27BrN2O2
Mass
407.352
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Phenethylamines
- Level 5 Amphetamines and 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
Amphetamines and derivatives
Alternative Parents
Phenylpropanes Phenoxy compounds Phenol ethers Aralkylamines Alkyl aryl ethers 2-halopyridines Aryl bromides Heteroaromatic compounds Dialkylamines Dialkyl ethers Azacyclic compounds Organobromides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Amphetamine or derivatives - Phenylpropane - Phenoxy compound - Phenol ether - Alkyl aryl ether - 2-halopyridine - Aralkylamine - Aryl bromide - Aryl halide - Pyridine - Heteroaromatic compound - Azacycle - Dialkyl ether - Secondary aliphatic amine - Ether - Organoheterocyclic compound - Secondary amine - Organic oxygen compound - Amine - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteromonocyclic 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