Compound Identification
SMILES
FC1=CC=C(C=C1)C1(CCCN2CCN(CC3CCC4=C(C3)C=C(F)C=C4)CC2)OCCO1
InChIKey
InChIKey=NAGCEASDCWLRPL-UHFFFAOYSA-N
Formula
C27H34F2N2O2
Mass
456.578
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
Tetralins N-alkylpiperazines Ketals Fluorobenzenes Aralkylamines Aryl fluorides 1,3-dioxolanes Trialkylamines Oxacyclic compounds Azacyclic compounds Organopnictogen compounds Organofluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylbutylamine - Tetralin - Fluorobenzene - Halobenzene - Ketal - N-alkylpiperazine - Aralkylamine - Aryl fluoride - Aryl halide - 1,4-diazinane - Piperazine - Meta-dioxolane - Tertiary amine - Tertiary aliphatic amine - Azacycle - Organoheterocyclic compound - Oxacycle - Acetal - Hydrocarbon derivative - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Organofluoride - Organonitrogen compound - Organooxygen compound - Organopnictogen compound - 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