Compound Identification
SMILES
[Cl-].CCN(CC)CCCOC1=C(C=CC(=C1)[N+]([O-])=O)C#N
InChIKey
InChIKey=YBQKLLSUUZXUKJ-UHFFFAOYSA-M
Formula
C14H19ClN3O3
Mass
312.77
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Nitrobenzenes
- Level 5 Nitrophenyl ethers
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Subclass
Nitrobenzenes
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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
Phenoxy compounds Phenol ethers Nitroaromatic compounds Benzonitriles Alkyl aryl ethers Trialkylamines Organic oxoazanium compounds Nitriles Organic oxides Organic chloride salts Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Nitrophenyl ether - Phenoxy compound - Nitroaromatic compound - Benzonitrile - Phenol ether - Alkyl aryl ether - C-nitro compound - Tertiary amine - Organic nitro compound - Tertiary aliphatic amine - Ether - Carbonitrile - Nitrile - Organic oxoazanium - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Cyanide - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic chloride salt - Organic salt - Organic cation - Aromatic homomonocyclic 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