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Chemistry, part 3

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > nitro compound > c-nitro compound > ro 61-8048
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > c-nitro compound > ro 61-8048
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > c-nitro compound > ro 61-8048

Preferred term

ro 61-8048  

Type

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

Broader concept

charge

  • 0

formula

  • C17H15N3O6S2

inchi

  • InChI=1S/C17H15N3O6S2/c1-25-15-7-6-13(9-16(15)26-2)28(23,24)19-17-18-14(10-27-17)11-4-3-5-12(8-11)20(21)22/h3-10H,1-2H3,(H,18,19)

inchikey

  • NDPBMCKQJOZAQX-UHFFFAOYSA-N

mass

  • 421.450

monoisotopicmass

  • 421.04023

smiles

  • COc1ccc(cc1OC)S(=O)(=O)Nc1nc(cs1)-c1cccc(c1)[N+]([O-])=O

subset

  • 2_STAR

synonym EXACT

  • Ro 61-8048

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:34953

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