Compound Identification
SMILES
OC(=O)C(O)=O.COCC1=NOC(=N1)C1=CCCN(C)C1
InChIKey
InChIKey=KQMDQYICQZFAQS-UHFFFAOYSA-N
Formula
C12H17N3O6
Mass
299.283
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyridines and derivatives
- Subclass Hydropyridines
-
Class
Pyridines and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
Hydropyridines
Intermediate Tree Nodes
Not available
Direct Parent
Hydropyridines
Alternative Parents
Dicarboxylic acids and derivatives Heteroaromatic compounds 1,2,4-oxadiazoles Trialkylamines Oxacyclic compounds Dialkyl ethers Carboxylic acids Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Not available
Substituents
Dicarboxylic acid or derivatives - Hydropyridine - 1,2,4-oxadiazole - Azole - Heteroaromatic compound - Oxadiazole - Tertiary amine - Tertiary aliphatic amine - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Oxacycle - Azacycle - Organic oxide - Amine - Organic oxygen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as hydropyridines. These are compounds containing a hydrogenated pyridine ring (i.e. containing less than the maximum number of double bonds.).
External Descriptors
Not available