Compound Identification
SMILES
CC1=CC(COC2=C(C=C(Cl)C=C2C=NN2C(=O)C3C4CC(C=C4)C3C2=O)[N+]([O-])=O)=CC=C1
InChIKey
InChIKey=BWTWUCMTIBHKOC-UHFFFAOYSA-N
Formula
C24H20ClN3O5
Mass
465.89
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
Isoindolones Phenoxy compounds Phenol ethers Nitroaromatic compounds Toluenes Alkyl aryl ethers Chlorobenzenes Pyrrolidine-2-ones Aryl chlorides Dicarboximides Lactams Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Hydrocarbon derivatives Organic oxides Organic salts Carbonyl compounds Organic zwitterions Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Nitrophenyl ether - Isoindolone - Isoindoline - Isoindole or derivatives - Phenoxy compound - Nitroaromatic compound - Phenol ether - Chlorobenzene - Halobenzene - Alkyl aryl ether - Toluene - Aryl halide - 2-pyrrolidone - Pyrrolidone - Aryl chloride - Dicarboximide - Pyrrolidine - Organic nitro compound - Lactam - C-nitro compound - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Ether - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic oxide - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Organic zwitterion - Organohalogen compound - Organic salt - Organochloride - Organonitrogen compound - Organooxygen 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