Structure Information
Structure

Compound Identification

SMILES

CC1C(C)C2C3C4C(SC5=C(C=C(C=C5)[N+]([O-])=O)[N+]([O-])=O)C3C1C2C4O[Cl](=O)(=O)=O

InChIKey

InChIKey=ZITKZLIEBDYSPB-UHFFFAOYSA-N

Formula

C18H19ClN2O8S

Mass

458.87

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Prenol lipids

Subclass

Monoterpenoids

Intermediate Tree Nodes

Not available

Direct Parent

Aromatic monoterpenoids

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Aromatic monoterpenoid - Nitrobenzene - Aryl thioether - Nitroaromatic compound - Thiophenol ether - Alkylarylthioether - Monocyclic benzene moiety - Organic perchlorate - Benzenoid - Organic perchlorate salt - Alkyl perchlorate - Organic nitro compound - C-nitro compound - Organic chlorate - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Sulfenyl compound - Thioether - Organic oxoazanium - Organic oxygen compound - Organic salt - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organosulfur compound - Organic oxide - Hydrocarbon derivative - Organic cation - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as aromatic monoterpenoids. These are monoterpenoids containing at least one aromatic ring.

External Descriptors

Not available

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