Compound Identification
SMILES
COC1=C(NC(=O)C(C)OC(=O)C2=C(C)C=CC(=C2)S(=O)(=O)NC2=CC=C(F)C=C2)C=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=ACISRDAXLCKHOT-UHFFFAOYSA-N
Formula
C24H22FN3O8S
Mass
531.51
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
P-toluenesulfonamides Sulfanilides Benzenesulfonamides Benzoic acid esters Anilides Benzenesulfonyl compounds Methoxyanilines Anisoles Phenoxy compounds Benzoyl derivatives Methoxybenzenes N-arylamides Nitroaromatic compounds Alkyl aryl ethers Fluorobenzenes Organosulfonamides Aryl fluorides Aminosulfonyl compounds Carboxylic acid esters Secondary carboxylic acid amides Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organofluorides Hydrocarbon derivatives Carbonyl compounds Organic oxides Organic salts Organic zwitterions
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Nitrophenyl ether - P-toluenesulfonamide - Sulfanilide - Benzoate ester - Benzenesulfonamide - Benzoic acid or derivatives - Anilide - Methoxyaniline - Benzenesulfonyl group - Nitroaromatic compound - Methoxybenzene - Anisole - N-arylamide - Phenol ether - Phenoxy compound - Benzoyl - Toluene - Alkyl aryl ether - Halobenzene - Fluorobenzene - Organosulfonic acid amide - Aryl fluoride - Aryl halide - Organic sulfonic acid or derivatives - Sulfonyl - Aminosulfonyl compound - Organosulfonic acid or derivatives - Organic nitro compound - Carboxamide group - Carboxylic acid ester - C-nitro compound - Secondary carboxylic acid amide - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Allyl-type 1,3-dipolar organic compound - Ether - Hydrocarbon derivative - Organic zwitterion - Organic oxygen compound - Carbonyl group - Organic oxide - Organohalogen compound - Organic salt - Organic nitrogen compound - Organofluoride - 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