Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(C=C1)C(=O)N1CC[NH+](CC2=CC3=C(OCO3)C=C2)CC1

InChIKey

InChIKey=YRVRPKJQHPYKSY-UHFFFAOYSA-O

Formula

C20H23N2O4

Mass

355.413

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzodioxoles

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Benzodioxoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzamide - Benzodioxole - Benzoic acid or derivatives - Anisole - Phenoxy compound - Benzoyl - Phenol ether - Methoxybenzene - Aralkylamine - Alkyl aryl ether - N-alkylpiperazine - Monocyclic benzene moiety - Benzenoid - 1,4-diazinane - Piperazine - Tertiary carboxylic acid amide - Carboxamide group - Tertiary aliphatic amine - Amino acid or derivatives - Tertiary amine - Ether - Carboxylic acid derivative - Acetal - Azacycle - Oxacycle - Organic oxide - Organopnictogen compound - Amine - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzodioxoles. These are organic compounds containing a benzene ring fused to either isomers of dioxole. Dioxole is a five-membered unsaturated ring of two oxygen atoms and three carbon atoms.

External Descriptors

Not available

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