Compound Identification
SMILES
COC1=C(NC(=O)CSC2=NN=C(O2)C2=NNC3=CC=CC=C23)C=CC(=C1)[N+]([O-])=O
InChIKey
InChIKey=NRUPRSNJPLZPDG-UHFFFAOYSA-N
Formula
C18H14N6O5S
Mass
426.41
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
Indazoles Methoxyanilines Anilides Anisoles Phenoxy compounds Nitroaromatic compounds N-arylamides Methoxybenzenes Alkyl aryl ethers Alkylarylthioethers Heteroaromatic compounds Pyrazoles 1,3,4-oxadiazoles Secondary carboxylic acid amides Organic oxoazanium compounds Oxacyclic compounds Propargyl-type 1,3-dipolar organic compounds Sulfenyl compounds Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Nitrophenyl ether - Anilide - Methoxyaniline - Indazole - Benzopyrazole - N-arylamide - Phenol ether - Phenoxy compound - Methoxybenzene - Aryl thioether - Nitroaromatic compound - Anisole - Alkylarylthioether - Alkyl aryl ether - Pyrazole - 1,3,4-oxadiazole - Heteroaromatic compound - Oxadiazole - Azole - Organic nitro compound - Secondary carboxylic acid amide - Carboxamide group - C-nitro compound - Oxacycle - Carboxylic acid derivative - Ether - Azacycle - Organoheterocyclic compound - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Thioether - Sulfenyl compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic salt - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic zwitterion - 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