Compound Identification
SMILES
COC1=CC=C(C=C1)N1C(SCC(=O)NC2=C(C=C(OC)C=C2)[N+]([O-])=O)=NN=C1C1=CC=NC=C1
InChIKey
InChIKey=XAQQHCOUNSSGPD-UHFFFAOYSA-N
Formula
C23H20N6O5S
Mass
492.51
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
Pyridyl-1,2,4-triazoles Phenyl-1,2,4-triazoles Anilides Methoxyanilines Anisoles Methoxybenzenes N-arylamides Nitroaromatic compounds Phenoxy compounds Alkyl aryl ethers Alkylarylthioethers Heteroaromatic compounds Secondary carboxylic acid amides Sulfenyl compounds Organic oxoazanium compounds Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic salts Organic zwitterions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenyltriazole - Phenyl-1,2,4-triazole - Nitrophenyl ether - Pyridyltriazole - Pyridyl-1,2,4-triazole - Anilide - Methoxyaniline - Anisole - Phenol ether - N-arylamide - Phenoxy compound - Aryl thioether - Nitroaromatic compound - Methoxybenzene - Alkyl aryl ether - Alkylarylthioether - Pyridine - Heteroaromatic compound - Triazole - 1,2,4-triazole - Azole - Organic nitro compound - C-nitro compound - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid derivative - Sulfenyl compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Thioether - Azacycle - Organic 1,3-dipolar compound - Ether - Organoheterocyclic compound - Organic oxoazanium - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic salt - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Organic zwitterion - Carbonyl group - Aromatic heteromonocyclic 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