Compound Identification
SMILES
CCCCC1=NN=C(N1CC1=CC=C(OC(C(O)=O)C2=CC=CC=C2)C=C1)S(=O)CC1=CC=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=WAEGWODVVCKFOT-UHFFFAOYSA-N
Formula
C28H28N4O6S
Mass
548.61
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
Benzyl sulfoxides Nitrobenzenes Nitroaromatic compounds Phenoxy compounds Phenol ethers Alkyl aryl ethers Triazoles Heteroaromatic compounds Sulfoxides Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Sulfinyl compounds Monocarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Organic salts Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic zwitterions Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenoxyacetate - Benzyl sulfoxide - Nitrobenzene - Phenoxy compound - Nitroaromatic compound - Phenol ether - Alkyl aryl ether - Azole - Heteroaromatic compound - 1,2,4-triazole - C-nitro compound - Sulfoxide - Organic nitro compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Sulfinyl compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Azacycle - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Organic oxoazanium - Organic zwitterion - Organonitrogen compound - Organic oxide - Organic nitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Carbonyl group - Organic oxygen compound - Organic salt - 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