Compound Identification
SMILES
COC(=O)COC1=C(Br)C=C(\C=N\NC2=NC=C(C=C2)[N+]([O-])=O)C=C1
InChIKey
InChIKey=NVEFMWLVVPOBJK-CNHKJKLMSA-N
Formula
C15H13BrN4O5
Mass
409.196
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenoxyacetic acid derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Phenoxyacetic acid derivatives
Alternative Parents
Phenoxy compounds Phenol ethers Nitroaromatic compounds Alkyl aryl ethers Bromobenzenes Pyridines and derivatives Aryl bromides Imidolactams Heteroaromatic compounds Methyl esters Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Hydrazones Organic oxoazanium compounds Monocarboxylic acids and derivatives Organic salts Organobromides Hydrocarbon derivatives Organic zwitterions Organic oxides Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenoxyacetate - Phenol ether - Phenoxy compound - Nitroaromatic compound - Alkyl aryl ether - Bromobenzene - Halobenzene - Aryl bromide - Pyridine - Aryl halide - Imidolactam - Methyl ester - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Carboxylic acid ester - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Azacycle - Hydrazone - Organic oxoazanium - Organic 1,3-dipolar compound - Monocarboxylic acid or derivatives - Organic oxide - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Organic zwitterion - Organic salt - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenoxyacetic acid derivatives. These are compounds containing an anisole where the methane group is linked to an acetic acid or a derivative.
External Descriptors
Not available