Compound Identification
SMILES
C[N+](C)(CCNC(=O)OC1CCCCC1O[N+]([O-])=O)CC(O)COC1=CC=CC=C1C#N
InChIKey
InChIKey=HOMSUCAGENLYQE-UHFFFAOYSA-O
Formula
C21H31N4O7
Mass
451.499
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Phenol ethers
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Phenol ethers
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Phenol ethers
Alternative Parents
Phenoxy compounds Benzonitriles Alkyl aryl ethers Tetraalkylammonium salts Alkyl nitrates Carbamate esters Secondary alcohols 1,2-aminoalcohols Organic nitro compounds Organic nitric acids and derivatives Nitriles Organic salts Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic cations
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenoxy compound - Benzonitrile - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Organic nitrate - Tetraalkylammonium salt - Quaternary ammonium salt - Alkyl nitrate - Carbamic acid ester - 1,2-aminoalcohol - Organic nitric acid or derivatives - Organic nitro compound - Secondary alcohol - Nitrile - Carbonitrile - Ether - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Alcohol - Organic oxide - Carbonyl group - Cyanide - Organic oxygen compound - Organic nitrogen compound - Amine - Organic salt - Organic cation - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenol ethers. These are aromatic compounds containing an ether group substituted with a benzene ring.
External Descriptors
Not available