Structure Information
Structure

Compound Identification

SMILES

NC(=O)C1=C(NC(=O)COC(=O)C=CC2=CC=C(C=C2)[N+]([O-])=O)SC2=C1CCC2

InChIKey

InChIKey=DIUPAFVQZDNBLO-UHFFFAOYSA-N

Formula

C19H17N3O6S

Mass

415.42

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Cinnamic acids and derivatives

Subclass

Cinnamic acid esters

Intermediate Tree Nodes

Not available

Direct Parent

Cinnamic acid esters

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Cinnamic acid ester - Nitrobenzene - Styrene - Thiophene carboxamide - Thiophene carboxylic acid or derivatives - N-arylamide - Nitroaromatic compound - Fatty acid ester - Fatty acyl - Monocyclic benzene moiety - Benzenoid - Vinylogous amide - Heteroaromatic compound - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Thiophene - Organic nitro compound - Carboxylic acid ester - C-nitro compound - Primary carboxylic acid amide - Carboxamide group - Secondary carboxylic acid amide - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Monocarboxylic acid or derivatives - Organic oxoazanium - Carboxylic acid derivative - Organic nitrogen compound - Organic zwitterion - Organic salt - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Carbonyl group - Organic oxide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as cinnamic acid esters. These are compound containing an ester derivative of cinnamic acid.

External Descriptors

Not available

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