Compound Identification
SMILES
OC(=O)COC1=C(CN2CCCN(CC2)S(=O)(=O)C2=CC=C(F)C=C2)C=C(C=C1)C(F)(F)F
InChIKey
InChIKey=NICXRKSDXYULRK-UHFFFAOYSA-N
Formula
C21H22F4N2O5S
Mass
490.47
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
Trifluoromethylbenzenes Benzenesulfonamides Benzenesulfonyl compounds Phenylmethylamines Phenoxy compounds Phenol ethers Benzylamines 1,4-diazepanes Alkyl aryl ethers Aralkylamines Fluorobenzenes Organosulfonamides Aryl fluorides Sulfonyls Amino acids Trialkylamines Carboxylic acids Azacyclic compounds Monocarboxylic acids and derivatives Carbonyl compounds Alkyl fluorides Hydrocarbon derivatives Organic oxides Organofluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenoxyacetate - Trifluoromethylbenzene - Benzenesulfonamide - Benzenesulfonyl group - Phenoxy compound - Benzylamine - Phenol ether - Phenylmethylamine - 1,4-diazepane - Alkyl aryl ether - Diazepane - Fluorobenzene - Halobenzene - Aralkylamine - Aryl fluoride - Aryl halide - Organosulfonic acid amide - Sulfonyl - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Tertiary amine - Tertiary aliphatic amine - Amino acid or derivatives - Amino acid - Ether - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organohalogen compound - Organofluoride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Amine - Alkyl halide - Alkyl fluoride - Organic oxygen 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