Structure Information
Structure

Compound Identification

SMILES

OC1=C2COC[C@@H](OCCOCCO[C@H](COCC1=CC(=C2)[N+]([O-])=O)C1=CC=CC=C1)C1=CC=CC=C1

InChIKey

InChIKey=VNEWZXRXWYBUKR-KAYWLYCHSA-N

Formula

C28H31NO8

Mass

509.555

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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 heteropolycyclic compounds

Substituents

Nitroaromatic compound - Monocyclic benzene moiety - Benzenoid - Dialkyl ether - Ether - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Oxacycle - Organic nitrogen compound - Organic oxygen compound - Organic zwitterion - Organooxygen compound - Organic salt - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Aromatic heteropolycyclic 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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