Compound Identification
SMILES
CCOC(=O)C(Br)(NC(=O)C1=C(N(CC2=CC=CC=C2)C=N1)[N+]([O-])=O)C(=O)OCC
InChIKey
InChIKey=VJWCSGRZSFJSGG-UHFFFAOYSA-N
Formula
C18H19BrN4O7
Mass
483.275
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
- Level 5 Amino acids and derivatives
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Subclass
Amino acids, peptides, and analogues
-
Class
Carboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
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
Direct Parent
N-acyl-alpha amino acids and derivatives
Alternative Parents
2-heteroaryl carboxamides Imidazolyl carboxylic acids and derivatives Nitroaromatic compounds Nitroimidazoles Carbonylimidazoles Benzene and substituted derivatives Dicarboxylic acids and derivatives N-substituted imidazoles Alpha-halocarboxylic acid derivatives Heteroaromatic compounds Vinylogous amides Carboxylic acid esters Secondary carboxylic acid amides Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Organic oxides Organobromides Organonitrogen compounds Hydrocarbon derivatives Alkyl bromides Carbonyl compounds Organic salts Organic zwitterions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - 2-heteroaryl carboxamide - Nitroaromatic compound - Imidazolyl carboxylic acid derivative - Nitroimidazole - Imidazole-4-carbonyl group - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - N-substituted imidazole - Benzenoid - Alpha-halocarboxylic acid derivative - Alpha-halocarboxylic acid or derivatives - Azole - Heteroaromatic compound - Imidazole - Vinylogous amide - Carboxamide group - Carboxylic acid ester - Organic nitro compound - C-nitro compound - Secondary carboxylic acid amide - Organic oxoazanium - Azacycle - Allyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic zwitterion - Organic salt - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Alkyl bromide - Organohalogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organobromide - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid (or a derivative thereof) which bears an acyl group at its terminal nitrogen atom.
External Descriptors
Not available