Structure Information
Structure

Compound Identification

SMILES

CC1=CC2=C(O\C(N2)=C2/C=C(NC(=O)C3=CC(=CC=C3)[N+]([O-])=O)C=CC2=O)C=C1

InChIKey

InChIKey=SLHPWFMEUZAUEL-LTGZKZEYSA-N

Formula

C21H15N3O5

Mass

389.367

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzoxazolines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Benzoxazolines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzamide - Benzoic acid or derivatives - Benzoxazoline - Nitrobenzene - Nitroaromatic compound - Benzoyl - O-quinomethane - Quinomethane - Monocyclic benzene moiety - Benzenoid - Vinylogous ester - Vinylogous amide - Carboxamide group - Ketene acetal or derivatives - Ketone - C-nitro compound - Organic nitro compound - Secondary carboxylic acid amide - Cyclic ketone - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Oxacycle - Azacycle - Organic oxoazanium - Organic nitrogen compound - Organic salt - Aldehyde - Carbonyl group - Organic oxygen compound - Organic zwitterion - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Organopnictogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzoxazolines. These are organic compounds containing a benzene ring fused to an oxazoline ring. Oxazoline is five-membered unsaturated ring with a nitrogen atom and an oxygen atom at the 1- and 3-position, respectively. Additionally, it contains two double bonds.

External Descriptors

Not available

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