Compound Identification
SMILES
CC(C)(C)OC(=O)N1CC[C@H]1COC1=CN=C(Cl)C(=C1)C#N
InChIKey
InChIKey=YLSPIWNXTFHLIL-NSHDSACASA-N
Formula
C15H18ClN3O3
Mass
323.78
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
Azetidinecarboxylic acids Alkyl aryl ethers 2-halopyridines Aryl chlorides Heteroaromatic compounds Carbamate esters Nitriles Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
3-pyridinecarbonitrile - Alkyl aryl ether - 2-halopyridine - Azetidinecarboxylic acid - Aryl chloride - Aryl halide - Heteroaromatic compound - Carbamic acid ester - Azetidine - Azacycle - Ether - Carbonitrile - Nitrile - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Cyanide - Organic oxygen compound - 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