Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=C(C=CC(=C1)[N+]([O-])=O)N(C)CC1=NOC(C)=C1

InChIKey

InChIKey=QGQGHUQUKHFOOH-UHFFFAOYSA-N

Formula

C14H15N3O5

Mass

305.29

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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

Nitrobenzoic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Nitrobenzoate - Aminobenzoic acid or derivatives - Benzoate ester - Nitrobenzene - Nitroaromatic compound - Benzoyl - Dialkylarylamine - Aniline or substituted anilines - Aralkylamine - Azole - Isoxazole - Heteroaromatic compound - Methyl ester - Vinylogous amide - Organic nitro compound - Tertiary amine - Carboxylic acid ester - Amino acid or derivatives - C-nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Azacycle - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic oxoazanium - Organic salt - Organooxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Amine - Organic cation - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as nitrobenzoic acids and derivatives. These are compounds containing a nitrobenzoic acid moiety, which consists of a benzene ring bearing both a carboxylic acid group and a nitro group on two different ring carbon atoms.

External Descriptors

Not available

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