Compound Identification
SMILES
CC(C)NCC(O)COC1=CC=CC2=C1C=CN2.CN(C)CCCC1(OCC2=C1C=CC(=C2)C#N)C1=CC=C(F)C=C1
InChIKey
InChIKey=OVKHEUQIQIEWTP-UHFFFAOYSA-N
Formula
C34H41FN4O3
Mass
572.725
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
Isocoumarans Indoles Phenol ethers Aralkylamines Alkyl aryl ethers Fluorobenzenes Aryl fluorides Pyrroles Heteroaromatic compounds Trialkylamines Secondary alcohols 1,2-aminoalcohols Dialkylamines Dialkyl ethers Azacyclic compounds Nitriles Oxacyclic compounds Hydrocarbon derivatives Organofluorides
Molecular Framework
Not available
Substituents
Phenylbutylamine - Indole or derivatives - Isocoumaran - Indole - Phenol ether - Alkyl aryl ether - Aralkylamine - Halobenzene - Fluorobenzene - Aryl halide - Aryl fluoride - Pyrrole - Heteroaromatic compound - Tertiary aliphatic amine - Tertiary amine - 1,2-aminoalcohol - Secondary alcohol - Dialkyl ether - Secondary aliphatic amine - Ether - Oxacycle - Azacycle - Organoheterocyclic compound - Secondary amine - Carbonitrile - Nitrile - Amine - Organic oxygen compound - Cyanide - Hydrocarbon derivative - Organic nitrogen compound - Alcohol - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen 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