Compound Identification
SMILES
BrC1[C@H]2OC[C@H](N2[C@@H](C[C@@H]1NCC1=CC=CC=C1)C#N)C1=CC=CC=C1
InChIKey
InChIKey=SGRUPNKDAHKWCC-KJYPTFROSA-N
Formula
C21H22BrN3O
Mass
412.331
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenylmethylamines
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylmethylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylmethylamines
Alternative Parents
Benzylamines Aralkylamines Aminopiperidines Oxazolidines Hemiaminals Oxacyclic compounds Nitriles Dialkylamines Azacyclic compounds Organooxygen compounds Organobromides Hydrocarbon derivatives Alkyl bromides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzylamine - Phenylmethylamine - 4-aminopiperidine - Aralkylamine - Piperidine - Oxazolidine - Hemiaminal - Secondary aliphatic amine - Carbonitrile - Nitrile - Oxacycle - Azacycle - Secondary amine - Organoheterocyclic compound - Organobromide - Organohalogen compound - Amine - Alkyl halide - Cyanide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Alkyl bromide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylmethylamines. These are compounds containing a phenylmethtylamine moiety, which consists of a phenyl group substituted by an methanamine.
External Descriptors
Not available