Compound Identification
SMILES
CO[C@@H](CNS(=O)(=O)C1=CC=C(Cl)C=C1)C1=CC=C(CC(O)=O)C=C1.CCCCCCN(C)CCC[C@](C#N)(C(C)C)C1=CC(OC)=C(OC)C(OC)=C1
InChIKey
InChIKey=SPMDCCBJMIQAPQ-SLBMUYKPSA-N
Formula
C41H58ClN3O8S
Mass
788.44
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
Benzenesulfonamides Phenylpropanes Benzenesulfonyl compounds Benzylethers Phenoxy compounds Anisoles Methoxybenzenes Alkyl aryl ethers Aralkylamines Chlorobenzenes Organosulfonamides Aryl chlorides Aminosulfonyl compounds Trialkylamines Nitriles Monocarboxylic acids and derivatives Dialkyl ethers Carboxylic acids Hydrocarbon derivatives Organochlorides Organic oxides Carbonyl compounds
Molecular Framework
Not available
Substituents
Phenylbutylamine - Benzenesulfonamide - Benzylether - Phenylpropane - Benzenesulfonyl group - Phenoxy compound - Methoxybenzene - Anisole - Phenol ether - Halobenzene - Aralkylamine - Alkyl aryl ether - Chlorobenzene - Aryl chloride - Aryl halide - Organosulfonic acid amide - Sulfonyl - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Aminosulfonyl compound - Tertiary amine - Tertiary aliphatic amine - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Organic oxygen compound - Organooxygen compound - Amine - Organic nitrogen compound - Carbonyl group - Organosulfur compound - Organonitrogen compound - Cyanide - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Organochloride - Aromatic homomonocyclic 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