Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C1=CC=C(C=C1)N=C1SC(CC(=O)N1CCC1=CC(OC)=C(OC)C=C1)C(=O)NC1=CC=C(I)C=C1

InChIKey

InChIKey=PLSPQKSHGOOPNY-UHFFFAOYSA-N

Formula

C30H30IN3O6S

Mass

687.55

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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

Not available

Direct Parent

Benzoic acid esters

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Dimethoxybenzene - O-dimethoxybenzene - Benzoate ester - Anilide - Phenol ether - N-arylamide - Phenoxy compound - Anisole - Methoxybenzene - Benzoyl - Alkyl aryl ether - Halobenzene - Iodobenzene - 1,3-thiazinane - Aryl halide - Aryl iodide - Carboxamide group - Carboxylic acid ester - Isothiourea - Secondary carboxylic acid amide - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic 1,3-dipolar compound - Ether - Propargyl-type 1,3-dipolar organic compound - Monocarboxylic acid or derivatives - Organopnictogen compound - Organic oxygen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organohalogen compound - Organoiodide - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid.

External Descriptors

Not available

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