Compound Identification
SMILES
CC(C)CN(C[C@@H](O)[C@H](CC1=CC=C(OCC2=CC=CC=N2)C=C1)NC(=O)O[C@H]1COC2OCCC12)S(=O)(=O)C1=CC=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=JHMSFLXJARBNDG-POHZBIKHSA-N
Formula
C33H40N4O10S
Mass
684.76
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
Amphetamines and derivatives Benzenesulfonamides Benzenesulfonyl compounds Nitrobenzenes Phenoxy compounds Phenol ethers Furofurans Nitroaromatic compounds Alkyl aryl ethers Pyridines and derivatives Organosulfonamides Oxolanes Aminosulfonyl compounds Carbamate esters Heteroaromatic compounds Secondary alcohols Acetals Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Organic oxoazanium compounds Organic zwitterions Organonitrogen compounds Organic salts Carbonyl compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylbutylamine - Amphetamine or derivatives - Benzenesulfonamide - Benzenesulfonyl group - Nitrobenzene - Phenoxy compound - Nitroaromatic compound - Furofuran - Phenol ether - Alkyl aryl ether - Organosulfonic acid amide - Pyridine - Sulfonyl - Carbamic acid ester - Aminosulfonyl compound - Oxolane - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - C-nitro compound - Secondary alcohol - Organic nitro compound - Acetal - Ether - Oxacycle - Organic oxoazanium - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organosulfur compound - Organopnictogen compound - Organic salt - Carbonyl group - Alcohol - Organic oxide - Organic zwitterion - 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