Compound Identification
SMILES
[Cl-].COC1=C(C=C(C[N+](C)(C)CCNC=O)C=C1)[N+]([O-])=O
InChIKey
InChIKey=OTJFCOFSJHKROQ-UHFFFAOYSA-N
Formula
C13H20ClN3O4
Mass
317.77
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Benzenoids
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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
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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
Methoxyanilines Phenylmethylamines Phenoxy compounds Anisoles Nitroaromatic compounds Methoxybenzenes Benzylamines Alkyl aryl ethers Aralkylamines Tetraalkylammonium salts Secondary carboxylic acid amides Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Carbonyl compounds Hydrocarbon derivatives Organic chloride salts Organic oxides Organic zwitterions
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Nitrophenyl ether - Methoxyaniline - Phenylmethylamine - Phenoxy compound - Nitroaromatic compound - Anisole - Benzylamine - Phenol ether - Methoxybenzene - Alkyl aryl ether - Aralkylamine - Quaternary ammonium salt - Tetraalkylammonium salt - C-nitro compound - Secondary carboxylic acid amide - Carboxamide group - Organic nitro compound - Carboxylic acid derivative - Ether - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organonitrogen compound - Organic oxygen compound - Organic chloride salt - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organic salt - Organic oxide - Carbonyl group - Organic zwitterion - 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