Structure Information
Structure

Compound Identification

SMILES

COC(=O)[C@@H]1C2CCC(C[C@@H]1OC(=O)C1=C(O)C=C(I)C=C1)N2C

InChIKey

InChIKey=QYYWMLHRGDGTBW-TVSZOZCSSA-N

Formula

C17H20INO5

Mass

445.253

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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

Benzoic acid esters

Direct Parent

o-Hydroxybenzoic acid esters

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

O-hydroxybenzoic acid ester - Salicylic acid or derivatives - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Piperidinecarboxylic acid - Tropane alkaloid - Benzoyl - 3-halophenol - 3-iodophenol - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Halobenzene - Iodobenzene - Phenol - Aryl halide - Aryl iodide - Dicarboxylic acid or derivatives - Piperidine - N-alkylpyrrolidine - Pyrrolidine - Methyl ester - Vinylogous acid - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid ester - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Amine - Organopnictogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organic nitrogen compound - Organohalogen compound - Organoiodide - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as o-hydroxybenzoic acid esters. These are benzoic acid esters where the benzene ring is ortho-substituted with a hydroxy group.

External Descriptors

Not available

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