Structure Information
Structure

Compound Identification

SMILES

[CH2-][NH+]1CCC2(CC1)OCC1=CC=CC=C21

InChIKey

InChIKey=GXVDVZWLADOZGU-UHFFFAOYSA-N

Formula

C13H17NO

Mass

203.285

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Isocoumarans

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Isocoumarans

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Isocoumaran - Isobenzofuran - Aralkylamine - Piperidine - Benzenoid - Quaternary ammonium salt - Tertiary amine - Tertiary aliphatic amine - Dialkyl ether - Ether - Oxacycle - Azacycle - Amine - Organic nitrogen compound - Ammonium ylide - Organic salt - Hydrocarbon derivative - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as isocoumarans. These are compounds containing the coumaran skeleton, which consists of a benzene ring fused to a 1,3-dihydrofuran ring.

External Descriptors

Not available

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