Compound Identification
SMILES
CCOC(=O)CC1=CN2C(S1)=NC(=C2C=O)C1=C(OC)C=CC(=C1)[N+]([O-])=O
InChIKey
InChIKey=HQNXVLMZANGKAC-UHFFFAOYSA-N
Formula
C17H15N3O6S
Mass
389.38
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
Nitrophenyl ethers Methoxyanilines Phenoxy compounds Anisoles Nitroaromatic compounds Methoxybenzenes Alkyl aryl ethers Aryl-aldehydes Carbonylimidazoles N-substituted imidazoles Thiazoles Heteroaromatic compounds Carboxylic acid esters Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Organic salts Organic zwitterions Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
4-phenylimidazole - 5-phenylimidazole - Nitrophenyl ether - Methoxyaniline - Nitrobenzene - Phenoxy compound - Phenol ether - Nitroaromatic compound - Methoxybenzene - Anisole - Alkyl aryl ether - Aryl-aldehyde - Imidazole-4-carbonyl group - Benzenoid - N-substituted imidazole - Monocyclic benzene moiety - Thiazole - Heteroaromatic compound - Carboxylic acid ester - C-nitro compound - Organic nitro compound - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Organic oxoazanium - Ether - Monocarboxylic acid or derivatives - Azacycle - Organic zwitterion - Organic nitrogen compound - Organic oxygen compound - Aldehyde - Organonitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organooxygen compound - Organic salt - Aromatic heteropolycyclic 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