Compound Identification
SMILES
NC1=NC(=CN1C1=C(NC(O)=O)C=CC(=C1)C(O)=O)C1=CC(=CC=C1)[N+]([O-])=O
InChIKey
InChIKey=UOFCSHMVGGEYKM-UHFFFAOYSA-N
Formula
C17H13N5O6
Mass
383.32
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
Phenylcarbamic acids Benzoic acids Nitrobenzenes 1,2,4-trisubstituted imidazoles Benzoyl derivatives Imidazolyl carboxylic acids and derivatives Nitroaromatic compounds N-substituted imidazoles Aminoimidazoles Heteroaromatic compounds Carbamic acids Amino acids Azacyclic compounds Carboxylic acids Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Primary amines Hydrocarbon derivatives Carbonyl compounds Organic oxides Organic salts Organic zwitterions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
4-phenylimidazole - 1-phenylimidazole - 5-phenylimidazole - Phenylcarbamic acid - Nitrobenzene - Benzoic acid - Benzoic acid or derivatives - Benzoyl - Imidazolyl carboxylic acid derivative - 1,2,4-trisubstituted-imidazole - Trisubstituted imidazole - Nitroaromatic compound - N-substituted imidazole - Monocyclic benzene moiety - Aminoimidazole - Benzenoid - Heteroaromatic compound - Amino acid or derivatives - Amino acid - Carbamic acid - Carbamic acid derivative - Organic nitro compound - C-nitro compound - Organic oxoazanium - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Azacycle - Carboxylic acid - Carboxylic acid derivative - Primary amine - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Amine - Organonitrogen compound - Organooxygen compound - Organic salt - Organic oxide - Organic zwitterion - 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