Compound Identification
SMILES
COC1=CC(OC)=C(Br)C=C1C1=NC(=C(N1)C1=C(C)C=CC(=C1)[N+]([O-])=O)C1=CC=CC=C1
InChIKey
InChIKey=JGVXHGRKHMPTNO-UHFFFAOYSA-N
Formula
C24H20BrN3O4
Mass
494.345
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Azoles
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Subclass
Imidazoles
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Level 5
Substituted imidazoles
- Level 6 Phenylimidazoles
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Level 5
Substituted imidazoles
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Subclass
Imidazoles
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Class
Azoles
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Imidazoles
Intermediate Tree Nodes
Substituted imidazoles
Direct Parent
Phenylimidazoles
Alternative Parents
Dimethoxybenzenes Nitrobenzenes Nitrotoluenes 2,4,5-trisubstituted imidazoles Phenoxy compounds Anisoles Nitroaromatic compounds Alkyl aryl ethers Bromobenzenes Aryl bromides Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Organic salts Organic zwitterions Hydrocarbon derivatives Organobromides Organonitrogen compounds Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylimidazole - 5-phenylimidazole - 4-phenylimidazole - M-dimethoxybenzene - Dimethoxybenzene - Nitrobenzene - Nitrotoluene - 2,4,5-trisubstituted-imidazole - Phenoxy compound - Nitroaromatic compound - Anisole - Phenol ether - Methoxybenzene - Trisubstituted imidazole - Alkyl aryl ether - Bromobenzene - Halobenzene - Toluene - Benzenoid - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Heteroaromatic compound - Organic nitro compound - C-nitro compound - Organic 1,3-dipolar compound - Azacycle - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Ether - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Organic nitrogen compound - Organobromide - Organic salt - Organic zwitterion - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylimidazoles. These are polycyclic aromatic compounds containing a benzene ring linked to an imidazole ring through a CC or CN bond.
External Descriptors
Not available