Compound Identification
SMILES
C1=CC=NC=C1.C\C=C\B1OB(OB(O1)\C=C/C)\C=C\C.CC(=C)C1=CC(=CC(=C1)N(C1=CC=CC=C1)S(C)(=O)=O)C(=O)N[C@@H](CC1=CC=CC=C1)[C@H](O)CNCC1=CC(=CC=C1)C(F)(F)F
InChIKey
InChIKey=CGLMIQHCHZIROE-WLBWSBQMSA-N
Formula
C49H56B3F3N4O7S
Mass
934.49
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
Trifluoromethylbenzenes Sulfanilides Amphetamines and derivatives Benzamides Phenylpropenes Styrenes Benzoyl derivatives Benzylamines Phenylmethylamines Organoboroxines Aralkylamines Organosulfonamides Pyridines and derivatives Organic sulfonamides Aminosulfonyl compounds Heteroaromatic compounds Secondary alcohols 1,2-aminoalcohols Secondary carboxylic acid amides Amino acids and derivatives Boronic acid derivatives Azacyclic compounds Oxacyclic compounds Dialkylamines Organic metalloid salts Alkyl fluorides Organofluorides Organic oxides Organometalloid compounds Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Phenylbutylamine - Amphetamine or derivatives - Trifluoromethylbenzene - Sulfanilide - Benzamide - Benzoic acid or derivatives - Phenylpropene - Benzoyl - Benzylamine - Phenylmethylamine - Styrene - Aralkylamine - Organoboroxine - Pyridine - Organosulfonic acid amide - Organic sulfonic acid amide - Heteroaromatic compound - Aminosulfonyl compound - Sulfonyl - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Secondary alcohol - Secondary carboxylic acid amide - Amino acid or derivatives - 1,2-aminoalcohol - Boronic acid derivative - Carboxamide group - Secondary amine - Organoheterocyclic compound - Organic metalloid salt - Azacycle - Oxacycle - Carboxylic acid derivative - Secondary aliphatic amine - Amine - Organohalogen compound - Organic metalloid moeity - Organofluoride - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organosulfur compound - Alcohol - Alkyl fluoride - Alkyl halide - 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