Compound Identification
SMILES
COC1=C(OS(=O)(=O)C2=CC(=C(C)C=C2)[N+]([O-])=O)C(C=O)=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=WIAMUSGBMLTQOM-UHFFFAOYSA-N
Formula
C15H12N2O9S
Mass
396.33
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-Methylbenzenesulfonates Benzenesulfonate esters Nitrobenzaldehydes Arylsulfonic acids and derivatives Benzenesulfonyl compounds Methoxyanilines Nitrotoluenes Benzaldehydes Nitroaromatic compounds Methoxybenzenes Benzoyl derivatives Anisoles Phenoxy compounds Alkyl aryl ethers Organosulfonic acid esters Sulfonyls Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Organic oxides Hydrocarbon derivatives Organic salts Organonitrogen compounds Organic cations
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
P-methylbenzenesulfonate - Nitrophenyl ether - Nitrobenzaldehyde - Benzenesulfonate ester - Benzenesulfonate - Methoxyaniline - Nitrotoluene - Arylsulfonic acid or derivatives - Benzenesulfonyl group - Phenoxy compound - Phenol ether - Nitroaromatic compound - Anisole - Methoxybenzene - Benzoyl - Benzaldehyde - Alkyl aryl ether - Aryl-aldehyde - Toluene - Organosulfonic acid ester - Organic sulfonic acid or derivatives - Sulfonyl - Organosulfonic acid or derivatives - Organic nitro compound - C-nitro compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic oxoazanium - Ether - Allyl-type 1,3-dipolar organic compound - Organic salt - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Aldehyde - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - 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