Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)C1=CC=C(C=C2CCCC3C(N(N=C23)C2=NC(=C(S2)C2=CC=CC=C2)C2=CC=CC=C2)C2=CC=C(C=C2)[N+]([O-])=O)C=C1

InChIKey

InChIKey=KWZIWLGOHYQDPM-UHFFFAOYSA-N

Formula

C35H27N5O4S

Mass

613.69

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Diarylheptanoids

Subclass

Linear diarylheptanoids

Intermediate Tree Nodes

Not available

Direct Parent

Linear diarylheptanoids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Linear 1,7-diphenylheptane skeleton - Nitrobenzene - 2,4,5-trisubstituted 1,3-thiazole - Nitroaromatic compound - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Azole - Pyrazoline - Thiazole - Organic nitro compound - C-nitro compound - N-alkylated hydrazone - Azacycle - Organoheterocyclic compound - Hydrazone - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxide - Organic nitrogen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic salt - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as linear diarylheptanoids. These are diarylheptanoids with an open heptane chain. The two aromatic rings are linked only by the heptane chain.

External Descriptors

Not available

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