Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Benzenesulfonic acid, 5-amino-2-(2-(4-(4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)-2-sulfophenyl)ethenyl)-
RN: 119-74-4
InChIKey: OQZZKKAUSICVQC-NSCUHMNNSA-N

Molecular Formula

  • C18-H17-N3-O7-S2

Molecular Weight

  • 451.478
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Regulatory Agencies (Superlist Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonym

  • EINECS 204-347-0

Systematic Names

  • 5-Amino-2-(2-(4-(4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)-2-sulphophenyl)vinyl)benzenesulphonic acid
  • Benzenesulfonic acid, 5-amino-2-(2-(4-(4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)-2-sulfophenyl)ethenyl)-

Registry Numbers

CAS Registry Number

  • 119-74-4

System Generated Number

  • 0000119744

Structure Descriptors

InChI

1S/C18H17N3O7S2/c1-11-8-18(22)21(20-11)15-7-5-13(17(10-15)30(26,27)28)3-2-12-4-6-14(19)9-16(12)29(23,24)25/h2-7,9-10H,8,19H2,1H3,(H,23,24,25)(H,26,27,28)/b3-2+

InChIKey

OQZZKKAUSICVQC-NSCUHMNNSA-N

Smiles

O=C1N(N=C(C)C1)c1ccc(c(S(=O)(=O)O)c1)\C=C\c1c(S(=O)(=O)O)cc(N)cc1