Compound Identification
SMILES
CN1CC=C2[C@H](C1)[C@H](C1=CC(O)=CC=C1)C(C#N)(C#N)C(N)=C2C#N
InChIKey
InChIKey=YQEXPWQWQQCOSX-IRXDYDNUSA-N
Formula
C19H17N5O
Mass
331.379
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Phenols
- Subclass 1-hydroxy-4-unsubstituted benzenoids
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Class
Phenols
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Phenols
Subclass
1-hydroxy-4-unsubstituted benzenoids
Intermediate Tree Nodes
Not available
Direct Parent
1-hydroxy-4-unsubstituted benzenoids
Alternative Parents
Aralkylamines 1-hydroxy-2-unsubstituted benzenoids Benzene and substituted derivatives Trialkylamines Nitriles Enamines Azacyclic compounds Organopnictogen compounds Organooxygen compounds Monoalkylamines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Aralkylamine - Monocyclic benzene moiety - Tertiary amine - Tertiary aliphatic amine - Enamine - Carbonitrile - Nitrile - Organoheterocyclic compound - Azacycle - Primary amine - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Amine - Hydrocarbon derivative - Primary aliphatic amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1-hydroxy-4-unsubstituted benzenoids. These are phenols that are unsubstituted at the 4-position.
External Descriptors
Not available