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Concept information

Preferred term

dithionitrobenzoic acid  

Type

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

charge

  • 0

formula

  • C14H8N2O8S2

has_role

inchi

  • InChI=1S/C14H8N2O8S2/c17-13(18)9-5-7(1-3-11(9)15(21)22)25-26-8-2-4-12(16(23)24)10(6-8)14(19)20/h1-6H,(H,17,18)(H,19,20)

inchikey

  • KIUMMUBSPKGMOY-UHFFFAOYSA-N

mass

  • 396.35200

monoisotopicmass

  • 395.97221

smiles

  • OC(=O)c1cc(SSc2ccc(c(c2)C(O)=O)[N+]([O-])=O)ccc1[N+]([O-])=O

subset

  • 3_STAR

synonym EXACT

  • 3,3'-disulfanediylbis(6-nitrobenzoic acid)

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:86228

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