Structure Information
Structure

Compound Identification

SMILES

COC1=C(I)C2=C(C(=O)OC2)C(=C1OC)[N+]([O-])=O

InChIKey

InChIKey=XZFSDTYNGYJTMU-UHFFFAOYSA-N

Formula

C10H8INO6

Mass

365.079

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Isocoumarans

Subclass

Isobenzofuranones

Intermediate Tree Nodes

Not available

Direct Parent

Phthalides

Alternative Parents

Methoxyanilines Anisoles Nitroaromatic compounds Alkyl aryl ethers Aryl iodides Carboxylic acid esters Lactones Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Organic oxoazanium compounds Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Organic zwitterions Organoiodides Organonitrogen compounds Organopnictogen compounds

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Phthalide - Methoxyaniline - Nitroaromatic compound - Anisole - Alkyl aryl ether - Aryl halide - Aryl iodide - Benzenoid - Carboxylic acid ester - Lactone - Organic nitro compound - C-nitro compound - Carboxylic acid derivative - Ether - Oxacycle - Monocarboxylic acid or derivatives - Organic 1,3-dipolar compound - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxide - Organopnictogen compound - Organohalogen compound - Organic nitrogen compound - Organoiodide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic zwitterion - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phthalides. These are compounds containing a 3-hydrocarbylidene-2-benzofuran-1(3H)-one moiety,.

External Descriptors

Not available

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