Compound Identification
SMILES
CC(C)(C)c1ccc(Oc2ccc(cn2)C#N)cc1
InChIKey
InChIKey=BVYMQQNGBCMJTB-UHFFFAOYSA-N
Formula
C16H16N2O
Mass
252.317
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenylpropanes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylpropanes
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpropanes
Alternative Parents
Polyhalopyridines Phenol ethers 3-pyridinecarbonitriles Methylpyridines 2-halopyridines Heteroaromatic compounds Nitriles Ethers Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylpropane - 3-pyridinecarbonitrile - Polyhalopyridine - Phenol ether - 2-halopyridine - Methylpyridine - Pyridine - Heteroaromatic compound - Azacycle - Organoheterocyclic compound - Nitrile - Ether - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpropanes. These are organic compounds containing a phenylpropane moiety.
External Descriptors
Not available