Compound Identification
SMILES
COC1=C(NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C2=CC=C(NC(C)=O)C=C2)C=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=JVFTUWXINBECOM-UHFFFAOYSA-N
Formula
C23H20N6O6S
Mass
508.51
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
Benzenesulfonamides Quinoxalines Acetanilides Benzenesulfonyl compounds Methoxyanilines N-acetylarylamines Phenoxy compounds Anisoles Methoxybenzenes Nitroaromatic compounds Alkyl aryl ethers Aminopyrazines Organosulfonamides Imidolactams Acetamides Heteroaromatic compounds Aminosulfonyl compounds Secondary carboxylic acid amides Amino acids and derivatives Secondary amines Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Azacyclic compounds Organic zwitterions Organic oxides Hydrocarbon derivatives Organic salts Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Nitrophenyl ether - Quinoxaline - Benzenesulfonamide - Acetanilide - Anilide - Methoxyaniline - Benzenesulfonyl group - N-acetylarylamine - Anisole - Phenoxy compound - Phenol ether - Methoxybenzene - N-arylamide - Aniline or substituted anilines - Nitroaromatic compound - Alkyl aryl ether - Aminopyrazine - Pyrazine - Imidolactam - Organosulfonic acid amide - Heteroaromatic compound - Acetamide - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Aminosulfonyl compound - Amino acid or derivatives - Secondary carboxylic acid amide - Organic nitro compound - Carboxamide group - C-nitro compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Propargyl-type 1,3-dipolar organic compound - Secondary amine - Allyl-type 1,3-dipolar organic compound - Azacycle - Carboxylic acid derivative - Ether - Organic oxoazanium - Organic oxide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic salt - Organic zwitterion - Amine - Organic oxygen compound - 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