Compound Identification
SMILES
COC1=CC=CC=C1NS(=O)(=O)C1=CC(C(=O)OC(C)C(=O)NC2=C(OC)C=CC(=C2)[N+]([O-])=O)=C(C)C=C1
InChIKey
InChIKey=VALAEWXYWPQAHW-UHFFFAOYSA-N
Formula
C25H25N3O9S
Mass
543.55
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
P-toluenesulfonamides Sulfanilides Benzenesulfonamides Benzoic acid esters Anilides Benzenesulfonyl compounds Methoxyanilines Anisoles Phenoxy compounds Benzoyl derivatives Methoxybenzenes N-arylamides Nitroaromatic compounds Alkyl aryl ethers Organosulfonamides Aminosulfonyl compounds Carboxylic acid esters Secondary carboxylic acid amides Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organic zwitterions Hydrocarbon derivatives Carbonyl compounds Organic oxides Organic salts
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Nitrophenyl ether - P-toluenesulfonamide - Sulfanilide - Benzoate ester - Benzenesulfonamide - Anilide - Methoxyaniline - Benzenesulfonyl group - Benzoic acid or derivatives - N-arylamide - Phenol ether - Anisole - Methoxybenzene - Nitroaromatic compound - Phenoxy compound - Benzoyl - Toluene - Alkyl aryl ether - Organosulfonic acid amide - Aminosulfonyl compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Organic nitro compound - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - C-nitro compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Propargyl-type 1,3-dipolar organic compound - Ether - Organic 1,3-dipolar compound - Organic oxoazanium - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organic salt - Organic oxide - Hydrocarbon derivative - Organic zwitterion - Organonitrogen compound - Organooxygen compound - Organosulfur compound - 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