Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)C1=CC=C(C=C1)C(OC(=O)CNC(=O)C1=CC=CS1)C(=O)C1=CC=CC=C1

InChIKey

InChIKey=UOCZUBHKTVTHFU-UHFFFAOYSA-N

Formula

C21H16N2O6S

Mass

424.43

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Stilbenes

Subclass

Benzoins

Intermediate Tree Nodes

Not available

Direct Parent

Benzoins

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Benzoin - Alpha-amino acid ester - N-acyl-alpha amino acid or derivatives - Alkyl-phenylketone - Alpha-amino acid or derivatives - Benzyloxycarbonyl - Nitrobenzene - Phenylketone - Thiophene carboxylic acid or derivatives - Thiophene carboxamide - 2-heteroaryl carboxamide - Aryl ketone - Aryl alkyl ketone - Benzoyl - Nitroaromatic compound - Alpha-acyloxy ketone - Benzenoid - Monocyclic benzene moiety - Thiophene - Heteroaromatic compound - Organic nitro compound - Carboxamide group - Carboxylic acid ester - Ketone - C-nitro compound - Secondary carboxylic acid amide - Organic oxoazanium - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Carboxylic acid derivative - Organic zwitterion - Organic oxygen compound - Carbonyl group - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic salt - Hydrocarbon derivative - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as benzoins. These are organic compounds containing a 1,2-hydroxy ketone attached to two phenyl groups.

External Descriptors

Not available

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