Compound Identification
SMILES
COC1=C(OC(=O)OCC2=CC(OC)=C(OC)C=C2[N+]([O-])=O)C=CC(CNC(C)=O)=C1
InChIKey
InChIKey=MRMOEUNMPNSOMW-UHFFFAOYSA-N
Formula
C20H22N2O9
Mass
434.401
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
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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
Benzyloxycarbonyls Dimethoxybenzenes Methoxyanilines Anisoles Phenoxy compounds Nitroaromatic compounds Alkyl aryl ethers Carbonic acid diesters Acetamides Secondary carboxylic acid amides Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Organic salts Hydrocarbon derivatives Organic zwitterions Carbonyl compounds Organonitrogen compounds Organic oxides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Nitrophenyl ether - Dimethoxybenzene - O-dimethoxybenzene - Benzyloxycarbonyl - Methoxyaniline - Phenol ether - Phenoxy compound - Nitroaromatic compound - Methoxybenzene - Anisole - Alkyl aryl ether - Carbonic acid diester - Acetamide - Secondary carboxylic acid amide - Carbonic acid derivative - C-nitro compound - Organic nitro compound - Carboxamide group - Carboxylic acid derivative - Ether - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Organic oxygen compound - Organic nitrogen compound - Organic salt - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - 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