Structure Information
Structure

Compound Identification

SMILES

O=C1O[C@H](COCC2=CC=CC=C2)C[C@H]2O[C@@H]12

InChIKey

InChIKey=OVPPGNZIKKZCQB-QJPTWQEYSA-N

Formula

C13H14O4

Mass

234.251

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzylethers

Intermediate Tree Nodes

Not available

Direct Parent

Benzylethers

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzylether - 1,4-dioxepane - Delta valerolactone - Dioxepane - Delta_valerolactone - Oxane - Carboxylic acid ester - Lactone - Organoheterocyclic compound - Ether - Oxirane - Oxacycle - Dialkyl ether - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organic oxide - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzylethers. These are aromatic ethers with the general formula ROCR' (R = alkyl, aryl; R'=benzene).

External Descriptors

Not available

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