Compound Identification
SMILES
COC1=CC(OC)=C(C=C1C=NNC(=O)C1=CC(Br)=CN=C1)[N+]([O-])=O
InChIKey
InChIKey=IOKBVVOWNCDIKD-UHFFFAOYSA-N
Formula
C15H13BrN4O5
Mass
409.196
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
Dimethoxybenzenes Methoxyanilines Nicotinamides Phenoxy compounds Anisoles Nitroaromatic compounds Alkyl aryl ethers Aryl bromides Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Carboxylic acids and derivatives Organic oxoazanium compounds Organic zwitterions Organobromides Organic salts Hydrocarbon derivatives Organonitrogen compounds Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Nitrophenyl ether - Dimethoxybenzene - M-dimethoxybenzene - Pyridine carboxylic acid or derivatives - Methoxyaniline - Nicotinamide - Phenol ether - Methoxybenzene - Phenoxy compound - Anisole - Nitroaromatic compound - Alkyl aryl ether - Aryl halide - Pyridine - Aryl bromide - Heteroaromatic compound - Organic nitro compound - C-nitro compound - 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 - Hydrocarbon derivative - Organohalogen compound - Organic oxide - Organobromide - Organonitrogen compound - Organooxygen compound - Organic salt - Organic nitrogen compound - Organic oxygen compound - 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