Compound Identification
SMILES
CC(C)CN(C[C@@H](O)[C@@H](N)CC1=CC=CC=C1)C(=O)C1=CC2=C(C=C1)N=C(O2)C(C)C
InChIKey
InChIKey=WTQIKFSVTPERAW-RBBKRZOGSA-N
Formula
C25H33N3O3
Mass
423.557
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenylbutylamines
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylbutylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylbutylamines
Alternative Parents
Amphetamines and derivatives Benzoxazoles Aralkylamines Tertiary carboxylic acid amides Oxazoles Heteroaromatic compounds Tertiary amines Secondary alcohols Amino acids and derivatives 1,2-aminoalcohols Oxacyclic compounds Azacyclic compounds Organic oxides Monoalkylamines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylbutylamine - Amphetamine or derivatives - Benzoxazole - Aralkylamine - Azole - Oxazole - Tertiary carboxylic acid amide - Heteroaromatic compound - Amino acid or derivatives - Tertiary amine - Secondary alcohol - 1,2-aminoalcohol - Carboxamide group - Organoheterocyclic compound - Oxacycle - Azacycle - Carboxylic acid derivative - Amine - Primary aliphatic amine - Organonitrogen compound - Organooxygen compound - Alcohol - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Primary amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylbutylamines. These are compounds containing a phenylbutylamine moiety, which consists of a phenyl group substituted at the fourth carbon by an butan-1-amine.
External Descriptors
Not available