Compound Identification
SMILES
CCOC(=O)COC1=C(OCC(=O)OCC)C=C(C(CNN(C(=O)C2=CC(C)=CC(C)=C2)C(C)(C)C)=C1)[N+]([O-])=O
InChIKey
InChIKey=LFDHUOSQVNCRQN-UHFFFAOYSA-N
Formula
C28H37N3O9
Mass
559.616
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
Nitrophenyl ethers Benzoic acids and derivatives m-Xylenes Phenoxy compounds Phenol ethers Benzoyl derivatives Nitroaromatic compounds Alkyl aryl ethers Dicarboxylic acids and derivatives Carboxylic acid esters Carboxylic acid hydrazides Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Hydrocarbon derivatives Organonitrogen compounds Carbonyl compounds Organic salts Organic oxides Organic cations
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Nitrophenyl ether - Phenoxyacetate - Benzoic acid or derivatives - Nitrobenzene - Benzoyl - Phenoxy compound - Phenol ether - Nitroaromatic compound - Xylene - M-xylene - Alkyl aryl ether - Dicarboxylic acid or derivatives - Organic nitro compound - Carboxylic acid ester - Carboxylic acid hydrazide - C-nitro compound - Organic oxoazanium - Ether - Carboxylic acid derivative - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organic salt - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Organic cation - Aromatic homomonocyclic 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