Compound Identification
SMILES
CC(C)CN(C[C@@H](O)[C@H](CC1=CC=CC=C1)NC(=O)OC1CO[C@H]2OCC[C@@H]12)S(=O)(=O)C1=CC2=C(OC=C2CN)C=C1
InChIKey
InChIKey=SBNJMSIDOLSKFJ-YDHFAUHBSA-N
Formula
C30H39N3O8S
Mass
601.72
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 Benzofurans Furofurans Aralkylamines Organosulfonamides Aminosulfonyl compounds Oxolanes Carbamate esters Furans Heteroaromatic compounds Secondary alcohols Acetals Oxacyclic compounds Carbonyl compounds Organopnictogen compounds Hydrocarbon derivatives Monoalkylamines Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylbutylamine - Amphetamine or derivatives - Benzofuran - Furofuran - Aralkylamine - Organosulfonic acid amide - Furan - Oxolane - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Heteroaromatic compound - Sulfonyl - Carbamic acid ester - Aminosulfonyl compound - Secondary alcohol - Oxacycle - Acetal - Organoheterocyclic compound - Amine - Alcohol - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Organopnictogen compound - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - 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