Compound Identification
SMILES
COC1=C(NC(=O)CSC2=NN=C(COC3=CC=C(Cl)C=C3)N2C)C=CC(=C1)[N+]([O-])=O
InChIKey
InChIKey=MXIXCOUMDBPOSP-UHFFFAOYSA-N
Formula
C19H18ClN5O5S
Mass
463.89
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
Methoxyanilines Anilides Methoxybenzenes N-arylamides Nitroaromatic compounds Anisoles Phenoxy compounds Chlorobenzenes Alkylarylthioethers Alkyl aryl ethers Aryl chlorides Heteroaromatic compounds Triazoles Secondary carboxylic acid amides Sulfenyl compounds Organic oxoazanium compounds Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Organochlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Nitrophenyl ether - Anilide - Methoxyaniline - Anisole - Phenoxy compound - Aryl thioether - Nitroaromatic compound - Phenol ether - N-arylamide - Methoxybenzene - Alkyl aryl ether - Chlorobenzene - Halobenzene - Alkylarylthioether - Aryl halide - Aryl chloride - Azole - 1,2,4-triazole - Heteroaromatic compound - C-nitro compound - Carboxamide group - Organic nitro compound - Secondary carboxylic acid amide - Organic 1,3-dipolar compound - Thioether - Carboxylic acid derivative - Ether - Organoheterocyclic compound - Organic oxoazanium - Sulfenyl compound - Propargyl-type 1,3-dipolar organic compound - Azacycle - Allyl-type 1,3-dipolar organic compound - Organic salt - Organohalogen compound - Organochloride - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organosulfur compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organic zwitterion - 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