Compound Identification
SMILES
COC1=C(OC)C=C(CC[N+]2=CC3=CC(OC)=C(OC)C=C3C=C2)C(Br)=C1
InChIKey
InChIKey=FUVGXPHLHVPAHY-UHFFFAOYSA-N
Formula
C21H23BrNO4
Mass
433.321
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Isoquinolines and derivatives
- Subclass 1-phenethylisoquinolines
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Class
Isoquinolines and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Isoquinolines and derivatives
Subclass
1-phenethylisoquinolines
Intermediate Tree Nodes
Not available
Direct Parent
1-phenethylisoquinolines
Alternative Parents
Dimethoxybenzenes Phenoxy compounds Anisoles Bromobenzenes Alkyl aryl ethers Pyridinium derivatives Aryl bromides Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Organobromides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenethylisoquinoline - O-dimethoxybenzene - Dimethoxybenzene - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Pyridine - Pyridinium - Benzenoid - Heteroaromatic compound - Ether - Azacycle - Organonitrogen compound - Organobromide - Organohalogen compound - Hydrocarbon derivative - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1-phenethylisoquinolines. These are organic aromatic compounds containing a quinoline ring system substituted at the 1-position by a phenethyl group.
External Descriptors
Not available