Structure Information
Structure

Compound Identification

SMILES

OC(=O)CS(O)(=O)=O.COC1C(OC)=CC=C2C=C3C=C4N(C=C(C)C5=CC(OC)=C(OC)C=C45)C=C3C=C12

InChIKey

InChIKey=VUXSQTUCWJXOFP-UHFFFAOYSA-N

Formula

C28H29NO9S

Mass

555.6

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Phenol ethers

Subclass

Anisoles

Intermediate Tree Nodes

Not available

Direct Parent

Anisoles

Alternative Parents

Alkyl aryl ethers Sulfonyls Organosulfonic acids Alkanesulfonic acids Trialkylamines Monocarboxylic acids and derivatives Enamines Dialkyl ethers Carboxylic acids Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds

Molecular Framework

Not available

Substituents

Anisole - Alkyl aryl ether - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Alkanesulfonic acid - Tertiary amine - Tertiary aliphatic amine - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Enamine - Ether - Monocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Amine - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as anisoles. These are organic compounds containing a methoxybenzene or a derivative thereof.

External Descriptors

Not available

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