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Concept information

... > organooxygen compound > carbonyl compound > carboxylic acid > aromatic carboxylic acid > benzoic acids > nitrobenzoic acid > 4-(1-imidazolyl)-3,5-dinitrobenzoic acid methyl ester
... > organooxygen compound > carbon oxoacid > carboxylic acid > aromatic carboxylic acid > benzoic acids > nitrobenzoic acid > 4-(1-imidazolyl)-3,5-dinitrobenzoic acid methyl ester
organic aromatic compound > aromatic carboxylic acid > benzoic acids > nitrobenzoic acid > 4-(1-imidazolyl)-3,5-dinitrobenzoic acid methyl ester
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > c-nitro compound > nitrobenzoic acid > 4-(1-imidazolyl)-3,5-dinitrobenzoic acid methyl ester

Preferred term

4-(1-imidazolyl)-3,5-dinitrobenzoic acid methyl ester  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C11H8N4O6

inchi

  • InChI=1S/C11H8N4O6/c1-21-11(16)7-4-8(14(17)18)10(9(5-7)15(19)20)13-3-2-12-6-13/h2-6H,1H3

inchikey

  • SDDIPIYYPSFJAV-UHFFFAOYSA-N

mass

  • 292.205

monoisotopicmass

  • 292.04438

smiles

  • COC(=O)C1=CC(=C(C(=C1)[N+](=O)[O-])N2C=CN=C2)[N+](=O)[O-]

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:105922

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