Structure Information
Structure

Compound Identification

SMILES

COC1=CC(=C(NC(=S)N2CCC3=C(C2)SC2=C3C(=NC(OC=O)C(=O)N2CCC2=CC=CC=C2)C2=CC=CC=C2C)C=C1)[N+]([O-])=O

InChIKey

InChIKey=WCMDUBMHRCWZLP-UHFFFAOYSA-N

Formula

C34H31N5O6S2

Mass

669.77

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Nitrobenzenes

Intermediate Tree Nodes

Not available

Direct Parent

Nitrophenyl ethers

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Nitrophenyl ether - Alpha-amino acid or derivatives - N-phenylthiourea - Thieno-para-diazepine - Methoxyaniline - Anisole - Phenoxy compound - Phenol ether - Nitroaromatic compound - Methoxybenzene - Alkyl aryl ether - Para-diazepine - Toluene - Heteroaromatic compound - Tertiary carboxylic acid amide - Thiophene - Organic nitro compound - Carboxamide group - Carboxylic acid ester - Ketimine - Lactam - C-nitro compound - Thiourea - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Organic oxoazanium - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Azacycle - Organic nitrogen compound - Organic oxide - Imine - Organic oxygen compound - Carbonyl group - Organonitrogen compound - Organic salt - Organooxygen compound - Hydrocarbon derivative - Organosulfur compound - Organic zwitterion - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as nitrophenyl ethers. These are aromatic compounds containing a nitrobenzene moiety that carries an ether group on the benzene ring.

External Descriptors

Not available

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