Structure Information
Structure

Compound Identification

SMILES

NC1=C(C(NCCO)=NC(NCCN2CCOCC2)=N1)[N+]([O-])=O

InChIKey

InChIKey=SRKSVBCTLRCHNO-UHFFFAOYSA-N

Formula

C12H21N7O4

Mass

327.345

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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 - Aminopyrimidine - Morpholine - Oxazinane - Pyrimidine - Imidolactam - Heteroaromatic compound - Tertiary amine - Tertiary aliphatic amine - Oxacycle - Azacycle - Propargyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Alkanolamine - Dialkyl ether - Ether - Organic oxoazanium - Organic salt - Primary alcohol - Organic oxide - Organooxygen compound - Organonitrogen compound - Primary amine - Organic oxygen compound - Hydrocarbon derivative - Alcohol - Organic nitrogen compound - Amine - Organic zwitterion - 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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