Compound Identification
SMILES
CC(C)CN(C[C@@H](O)[C@H](CC1=CC=CC=C1)NC(=O)O[C@H]1CCOC1)S(=O)(=O)C1=CC(Cl)=C(NC(C)=O)C=C1
InChIKey
InChIKey=IPQCCYBJFSPUJN-OUIFVKKZSA-N
Formula
C27H36ClN3O7S
Mass
582.11
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenylbutylamines
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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
O-haloacetanilides Amphetamines and derivatives Benzenesulfonamides Benzenesulfonyl compounds N-acetylarylamines Chlorobenzenes Organosulfonamides Aryl chlorides Tetrahydrofurans Acetamides Carbamate esters Aminosulfonyl compounds Secondary carboxylic acid amides Organic carbonic acids and derivatives Secondary alcohols Oxacyclic compounds Dialkyl ethers Organochlorides Organopnictogen compounds Organic oxides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
O-haloacetanilide - Haloacetanilide - Phenylbutylamine - Amphetamine or derivatives - Acetanilide - Benzenesulfonamide - Anilide - N-acetylarylamine - Benzenesulfonyl group - N-arylamide - Chlorobenzene - Halobenzene - Aryl chloride - Organosulfonic acid amide - Aryl halide - Acetamide - Aminosulfonyl compound - Carbamic acid ester - Tetrahydrofuran - Sulfonyl - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Carboxamide group - Carbonic acid derivative - Secondary carboxylic acid amide - Secondary alcohol - Carboxylic acid derivative - Oxacycle - Dialkyl ether - Ether - Organoheterocyclic compound - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Alcohol - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Aromatic heteromonocyclic 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