Structure Information
Structure

Compound Identification

SMILES

COC(=O)[C@H](COC(=O)C1=CC=C(C=C1)[N+]([O-])=O)NC(=O)N(CCCl)N=O

InChIKey

InChIKey=ZJSXLCOPQQSOLE-NSHDSACASA-N

Formula

C14H15ClN4O8

Mass

402.74

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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 - Alpha amino acids and derivatives - N-carbamoyl-alpha amino acids and derivatives

Direct Parent

N-carbamoyl-alpha amino acids

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Alpha-amino acid ester - N-carbamoyl-alpha-amino acid - Nitrobenzoate - Benzoate ester - Benzoic acid or derivatives - Nitrobenzene - Nitroaromatic compound - Benzoyl - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Nitrosourea - Benzenoid - Nitrosamide - Semicarbazide - Methyl ester - Organic n-nitroso compound - Carboxylic acid ester - C-nitro compound - Organic nitro compound - Carbonic acid derivative - Allyl-type 1,3-dipolar organic compound - Organic nitroso compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic oxoazanium - Organohalogen compound - Alkyl chloride - Hydrocarbon derivative - Organic oxide - Alkyl halide - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as n-carbamoyl-alpha amino acids. These are compounds containing an alpha amino acid which bears an carbamoyl group at its terminal nitrogen atom.

External Descriptors

Not available

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