Compound Identification
SMILES
CCCN1C=C(O)C(=NNC2=NN(C(C)=O)C(=N2)[N+]([O-])=O)C1=O
InChIKey
InChIKey=HEDKTRPHNMXCPA-UHFFFAOYSA-N
Formula
C11H13N7O5
Mass
323.269
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic 1,3-dipolar compounds
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Class
Allyl-type 1,3-dipolar organic compounds
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Subclass
Organic nitro compounds
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Level 5
C-nitro compounds
- Level 6 Nitroaromatic compounds
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Level 5
C-nitro compounds
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Subclass
Organic nitro compounds
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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
C-nitro compounds
Direct Parent
Nitroaromatic compounds
Alternative Parents
Triazoles Tertiary carboxylic acid amides Pyrrolines Heteroaromatic compounds Acetamides Lactams Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Hydrazones Azacyclic compounds Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Nitroaromatic compound - Azole - Pyrroline - Tertiary carboxylic acid amide - 1,2,4-triazole - Heteroaromatic compound - Acetamide - Carboxamide group - Lactam - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Hydrazone - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Organic salt - Organic zwitterion - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as nitroaromatic compounds. These are c-nitro compounds where the nitro group is C-substituted with an aromatic group.
External Descriptors
Not available