Compound Identification
SMILES
Cl.NCCOC(=O)COC1=CC=CC=C1C(=O)NC1=NC=C(S1)[N+]([O-])=O
InChIKey
InChIKey=IPWAWYRIZNIEJU-UHFFFAOYSA-N
Formula
C14H15ClN4O6S
Mass
402.81
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
Benzamides Phenoxy compounds Phenol ethers Nitrothiazoles Nitroaromatic compounds Benzoyl derivatives 2,5-disubstituted thiazoles Alkyl aryl ethers Heteroaromatic compounds Secondary carboxylic acid amides Amino acids and derivatives Carboxylic acid esters Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Azacyclic compounds Monocarboxylic acids and derivatives Organic zwitterions Organic oxides Carbonyl compounds Monoalkylamines Hydrochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenoxyacetate - Benzamide - Benzoic acid or derivatives - Phenoxy compound - Nitroaromatic compound - Benzoyl - Nitrothiazole - Phenol ether - 2,5-disubstituted 1,3-thiazole - Alkyl aryl ether - Azole - Heteroaromatic compound - Thiazole - Amino acid or derivatives - Organic nitro compound - Carboxamide group - Carboxylic acid ester - C-nitro compound - Secondary carboxylic acid amide - Propargyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic oxoazanium - Azacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Ether - Organic salt - Primary aliphatic amine - Organic nitrogen compound - Amine - Carbonyl group - Organic oxygen compound - Hydrochloride - Hydrocarbon derivative - Primary amine - Organic oxide - Organonitrogen compound - Organic zwitterion - Organooxygen compound - 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