Compound Identification
SMILES
NC1=C(C#N)C(=C(C#N)C#N)C2(N1)OCCO2
InChIKey
InChIKey=QAPJUJXNMHQPNJ-UHFFFAOYSA-N
Formula
C10H7N5O2
Mass
229.199
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Orthocarboxylic acid derivatives
- Subclass Carboxylic acid amide acetals
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Class
Orthocarboxylic acid derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Orthocarboxylic acid derivatives
Subclass
Carboxylic acid amide acetals
Intermediate Tree Nodes
Not available
Direct Parent
Carboxylic acid amide acetals
Alternative Parents
Pyrrolines 1,3-dioxolanes Ketene acetals Oxacyclic compounds Nitriles Dialkylamines Azacyclic compounds Organopnictogen compounds Monoalkylamines Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Amide acetal - Meta-dioxolane - Pyrroline - Ketene acetal or derivatives - Secondary aliphatic amine - Carbonitrile - Nitrile - Secondary amine - Organoheterocyclic compound - Azacycle - Oxacycle - Amine - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organopnictogen compound - Primary aliphatic amine - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as carboxylic acid amide acetals. These are carboxylic acid derivatives two hydroxyl groups attached to a carbon atom, which in turn is linked to a nitrogen atom(substituted or not).
External Descriptors
Not available