Compound Identification
SMILES
NC1=CC=C(O1)C=C(C#N)C#N
InChIKey
InChIKey=LSCWPOJXDWATRP-UHFFFAOYSA-N
Formula
C8H5N3O
Mass
159.148
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic nitrogen compounds
-
Class
Organonitrogen compounds
-
Subclass
Amines
-
Level 5
Primary amines
- Level 6 Primary aromatic amines
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Level 5
Primary amines
-
Subclass
Amines
-
Class
Organonitrogen compounds
-
Superclass
Organic nitrogen compounds
Kingdom
Organic compounds
Superclass
Organic nitrogen compounds
Class
Organonitrogen compounds
Subclass
Amines
Intermediate Tree Nodes
Primary amines
Direct Parent
Primary aromatic amines
Alternative Parents
Heteroaromatic compounds Furans Oxacyclic compounds Nitriles Organopnictogen compounds Organooxygen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Primary aromatic amine - Heteroaromatic compound - Furan - Oxacycle - Organoheterocyclic compound - Nitrile - Carbonitrile - Organic oxygen compound - Organopnictogen compound - Cyanide - Hydrocarbon derivative - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as primary aromatic amines. These are primary amines where the only hydrocarbyl substituent of the amine group is aromatic. Primary amines have the general formula RNH2 (R=aryl).
External Descriptors
Not available