Structure Information
Structure

Compound Identification

SMILES

COC1=C(OC)C=C(C=C1)C1=C2C(=CS1)C=CC(=C2C(=O)N1CCOCC1)[N+]([O-])=O

InChIKey

InChIKey=LCCNEMWNXTWMDI-UHFFFAOYSA-N

Formula

C21H20N2O6S

Mass

428.46

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Methoxybenzenes

Intermediate Tree Nodes

Not available

Direct Parent

Dimethoxybenzenes

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Dimethoxybenzene - O-dimethoxybenzene - Benzothiophene - 2-benzothiophene - Morpholine-4-carboxylic acid or derivatives - Phenoxy compound - Nitroaromatic compound - Anisole - Phenol ether - Alkyl aryl ether - Morpholine - Oxazinane - Heteroaromatic compound - Tertiary carboxylic acid amide - Thiophene - Organic nitro compound - Carboxamide group - C-nitro compound - Tertiary amine - Amino acid or derivatives - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Azacycle - Oxacycle - Allyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Organic oxoazanium - Carboxylic acid derivative - Dialkyl ether - Ether - Amine - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic salt - Organonitrogen compound - Organic oxide - Organooxygen compound - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as dimethoxybenzenes. These are organic aromatic compounds containing a monocyclic benzene moiety carrying exactly two methoxy groups.

External Descriptors

Not available

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