Structure Information
Structure

Compound Identification

SMILES

COC1=C(OC)C=C2[C@@H]([C@H](CCC2=C1)[N+]([O-])=O)C1=C(SC(CC(C)C)=C1)C(=O)NC(C)(C)C

InChIKey

InChIKey=WJWPBHMHCWKBQO-SIKLNZKXSA-N

Formula

C25H34N2O5S

Mass

474.62

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Naphthalenes

Subclass

Nitronaphthalenes

Intermediate Tree Nodes

Not available

Direct Parent

Nitronaphthalenes

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

2-nitronaphthalene - Tetralin - Anisole - 2-heteroaryl carboxamide - Phenol ether - Thiophene carboxamide - Thiophene carboxylic acid or derivatives - 2,3,5-trisubstituted thiophene - Alkyl aryl ether - Heteroaromatic compound - Thiophene - Organic nitro compound - C-nitro compound - Secondary carboxylic acid amide - Carboxamide group - Organic 1,3-dipolar compound - Organoheterocyclic compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Ether - Carboxylic acid derivative - Organic oxygen compound - Organic salt - Organonitrogen compound - Organooxygen compound - Organic zwitterion - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as nitronaphthalenes. These are polycyclic aromatic compounds containing a naphthalene moiety substituted by one or more nitro groups.

External Descriptors

Not available

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