Compound Identification
SMILES
CCC1=C(C=C(C#N)C(=O)N1)C(O)C(C)Br
InChIKey
InChIKey=JELBBIYMTBWGFK-UHFFFAOYSA-N
Formula
C11H13BrN2O2
Mass
285.141
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyridines and derivatives
- Subclass 3-pyridinecarbonitriles
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Class
Pyridines and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
3-pyridinecarbonitriles
Intermediate Tree Nodes
Not available
Direct Parent
3-pyridinecarbonitriles
Alternative Parents
Pyridinones Dihydropyridines Heteroaromatic compounds Secondary alcohols Lactams Bromohydrins Nitriles Azacyclic compounds Organobromides Organic oxides Hydrocarbon derivatives Aromatic alcohols Alkyl bromides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
3-pyridinecarbonitrile - Dihydropyridine - Pyridinone - Hydropyridine - Heteroaromatic compound - Bromohydrin - Halohydrin - Lactam - Secondary alcohol - Carbonitrile - Nitrile - Azacycle - Organonitrogen compound - Organobromide - Organohalogen compound - Alkyl bromide - Alcohol - Hydrocarbon derivative - Organic oxide - Cyanide - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Alkyl halide - Aromatic alcohol - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 3-pyridinecarbonitriles. These are organic compounds containing a pyridine ring substituted at the 3-position by a carbonitrile group.
External Descriptors
Not available