Structure Information
Structure

Compound Identification

SMILES

CC1=CC(=C(C)O1)C1=NN=C(CN2N=C(C)C(=C2C)[N+]([O-])=O)O1

InChIKey

InChIKey=YHJRSRNKNRVZFX-UHFFFAOYSA-N

Formula

C14H15N5O4

Mass

317.305

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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

Intermediate Tree Nodes

C-nitro compounds

Direct Parent

Nitroaromatic compounds

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Nitroaromatic compound - 1,3,4-oxadiazole - Azole - Furan - Oxadiazole - Heteroaromatic compound - Pyrazole - Organic oxoazanium - Oxacycle - Propargyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Azacycle - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic salt - Organic oxide - Organic nitrogen compound - Organic cation - 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

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