Compound Identification
SMILES
Cl.CCCCN1CCC(CC1)NCCCC(C#N)(C(C)C)C1=CC(OC)=C(OC)C=C1
InChIKey
InChIKey=VMQLMGOTYJKFTR-UHFFFAOYSA-N
Formula
C25H42ClN3O2
Mass
452.08
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
Dimethoxybenzenes Phenylpropanes Phenoxy compounds Anisoles Aralkylamines Aminopiperidines Alkyl aryl ethers Trialkylamines Nitriles Dialkylamines Azacyclic compounds Hydrochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylbutylamine - O-dimethoxybenzene - Dimethoxybenzene - Phenylpropane - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - 4-aminopiperidine - Aralkylamine - Piperidine - Tertiary aliphatic amine - Tertiary amine - Secondary aliphatic amine - Ether - Carbonitrile - Nitrile - Azacycle - Organoheterocyclic compound - Secondary amine - Cyanide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Hydrochloride - Organic nitrogen compound - Amine - 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