Compound Identification
SMILES
CC1C(C#N)(C#N)C(C#N)=C(N)C1(Cl)[N+]([O-])=O
InChIKey
InChIKey=CWRGCDKIXIGGAV-UHFFFAOYSA-N
Formula
C9H6ClN5O2
Mass
251.63
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic 1,3-dipolar compounds
-
Class
Allyl-type 1,3-dipolar organic compounds
-
Subclass
Organic nitro compounds
- Level 5 C-nitro compounds
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Subclass
Organic nitro compounds
-
Class
Allyl-type 1,3-dipolar organic compounds
-
Superclass
Organic 1,3-dipolar compounds
Kingdom
Organic compounds
Superclass
Organic 1,3-dipolar compounds
Class
Allyl-type 1,3-dipolar organic compounds
Subclass
Organic nitro compounds
Intermediate Tree Nodes
Not available
Direct Parent
C-nitro compounds
Alternative Parents
Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Nitriles Enamines Organopnictogen compounds Organochlorides Organic zwitterions Organic oxides Monoalkylamines Hydrocarbon derivatives Alkyl chlorides
Molecular Framework
Aliphatic homomonocyclic compounds
Substituents
C-nitro compound - Enamine - Carbonitrile - Nitrile - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Organic zwitterion - Primary amine - Organonitrogen compound - Organochloride - Amine - Organohalogen compound - Organic nitrogen compound - Alkyl halide - Alkyl chloride - Primary aliphatic amine - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aliphatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as c-nitro compounds. These are compounds having the nitro group, -NO2 (free valence on nitrogen), which is attached to carbon.
External Descriptors
Not available