Compound Identification
SMILES
C[C@@H](OC1=CC=C(Br)C=C1)[C@H](O)CCC1=CN=CC=C1
InChIKey
InChIKey=VQCJGQMRUJLGMA-MLGOLLRUSA-N
Formula
C16H18BrNO2
Mass
336.229
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Phenol ethers
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Phenol ethers
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Phenol ethers
Alternative Parents
Phenoxy compounds Bromobenzenes Alkyl aryl ethers Pyridines and derivatives Aryl bromides Heteroaromatic compounds Secondary alcohols Azacyclic compounds Organonitrogen compounds Organobromides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenoxy compound - Phenol ether - Alkyl aryl ether - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Pyridine - Heteroaromatic compound - Secondary alcohol - Azacycle - Organoheterocyclic compound - Ether - Organooxygen compound - Organic nitrogen compound - Alcohol - Hydrocarbon derivative - Organic oxygen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenol ethers. These are aromatic compounds containing an ether group substituted with a benzene ring.
External Descriptors
Not available