Structure Information
Structure

Compound Identification

SMILES

CC1=C(C=C(C=C1)C1=N\C(=C\C2=C(F)C=CC(Br)=C2)C(=O)O1)[N+]([O-])=O

InChIKey

InChIKey=PEXQZPGZVIKPHN-VGOFMYFVSA-N

Formula

C17H10BrFN2O4

Mass

405.179

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Subclass

Amino acids, peptides, and analogues

Intermediate Tree Nodes

Amino acids and derivatives

Direct Parent

Alpha amino acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Alpha-amino acid or derivatives - Nitrobenzene - Nitrotoluene - Nitroaromatic compound - Bromobenzene - Fluorobenzene - Halobenzene - Toluene - 4-hydrocarbylideneazlactone - Aryl halide - Benzenoid - Aryl fluoride - Monocyclic benzene moiety - Aryl bromide - Oxazoline - Organic nitro compound - C-nitro compound - Organoheterocyclic compound - Oxacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Azacycle - Monocarboxylic acid or derivatives - Organic oxoazanium - Organic oxide - Organopnictogen compound - Organohalogen compound - Organic oxygen compound - Organobromide - Organofluoride - Organonitrogen compound - Carbonyl group - Organic nitrogen compound - Organooxygen compound - Organic salt - Hydrocarbon derivative - Organic cation - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof.

External Descriptors

Not available

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