Structure Information
Structure

Compound Identification

SMILES

COC1=C(C=C(C=C1)C(=O)OCC(=O)C1=CC=CN1)S(=O)(=O)N1CCOCC1

InChIKey

InChIKey=SBNIVLXYJFVIMJ-UHFFFAOYSA-N

Formula

C18H20N2O7S

Mass

408.43

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzoic acids and derivatives

Intermediate Tree Nodes

Methoxybenzoic acids and derivatives

Direct Parent

P-methoxybenzoic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

P-methoxybenzoic acid or derivatives - Benzenesulfonamide - Benzoate ester - Benzenesulfonyl group - Phenoxy compound - Anisole - Benzoyl - Phenol ether - Aryl ketone - Methoxybenzene - Aryl alkyl ketone - Alkyl aryl ether - Oxazinane - Substituted pyrrole - Organosulfonic acid amide - Morpholine - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Heteroaromatic compound - Sulfonyl - Pyrrole - Carboxylic acid ester - Ketone - Carboxylic acid derivative - Oxacycle - Dialkyl ether - Ether - Azacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Organic oxygen compound - Organic nitrogen compound - Aldehyde - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as p-methoxybenzoic acids and derivatives. These are benzoic acids in which the hydrogen atom at position 4 of the benzene ring is replaced by a methoxy group.

External Descriptors

Not available

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