Compound Identification
SMILES
[Cl-].[Cl-].C[NH+](CC(O)COC1=CC=C(C=C1)[N+]([O-])=O)CC1=NC2=CC=CC=C2[NH2+]1
InChIKey
InChIKey=VQVQPPXYBQCCAD-UHFFFAOYSA-N
Formula
C18H22Cl2N4O4
Mass
429.3
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Nitrobenzenes
- Level 5 Nitrophenyl ethers
-
Subclass
Nitrobenzenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Nitrobenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Nitrophenyl ethers
Alternative Parents
Benzimidazoles Phenoxy compounds Phenol ethers Nitroaromatic compounds Alkyl aryl ethers Quaternary ammonium salts Trialkylamines Secondary alcohols 1,2-aminoalcohols Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Carboxamidines Organic zwitterions Hydrocarbon derivatives Organic oxides Organic chloride salts
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Nitrophenyl ether - Benzimidazole - Phenoxy compound - Nitroaromatic compound - Phenol ether - Alkyl aryl ether - Quaternary ammonium salt - 1,2-aminoalcohol - C-nitro compound - Secondary alcohol - Tertiary amine - Tertiary aliphatic amine - Organic nitro compound - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Carboxylic acid amidine - Ether - Organic oxoazanium - Amidine - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organonitrogen compound - Organic chloride salt - Alcohol - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Amine - Organic zwitterion - Organic salt - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as nitrophenyl ethers. These are aromatic compounds containing a nitrobenzene moiety that carries an ether group on the benzene ring.
External Descriptors
Not available