Compound Identification
SMILES
COC1=C(NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC2CCCO2)C=CC(=C1)[N+]([O-])=O
InChIKey
InChIKey=IPMQUYXVBPWSBK-UHFFFAOYSA-N
Formula
C22H22N4O6S
Mass
470.5
Taxonomic Classification
Taxonomy Tree
-
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
Quinazolines Anilides Methoxyanilines Phenoxy compounds Anisoles Methoxybenzenes Nitroaromatic compounds N-arylamides Alkyl aryl ethers Pyrimidones Alkylarylthioethers Oxolanes Heteroaromatic compounds Secondary carboxylic acid amides Lactams Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Dialkyl ethers Organic oxoazanium compounds Organopnictogen compounds Organic zwitterions Hydrocarbon derivatives Organic salts Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Nitrophenyl ether - Diazanaphthalene - Quinazoline - Anilide - Methoxyaniline - N-arylamide - Phenoxy compound - Aryl thioether - Methoxybenzene - Phenol ether - Anisole - Nitroaromatic compound - Alkylarylthioether - Alkyl aryl ether - Pyrimidone - Pyrimidine - Heteroaromatic compound - Oxolane - Organic nitro compound - Secondary carboxylic acid amide - C-nitro compound - Carboxamide group - Lactam - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Sulfenyl compound - Thioether - Organic 1,3-dipolar compound - Ether - Organoheterocyclic compound - Azacycle - Oxacycle - Dialkyl ether - Carboxylic acid derivative - Organic oxoazanium - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic zwitterion - Organic salt - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Carbonyl group - Organic oxygen compound - 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