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Substance Name: EINECS 277-096-8
RN: 72928-86-0
InChIKey: NYWRPTNOQLMKFW-GQPWVPPYSA-M

Molecular Formula

  • C42-H44-Cr-N12-O12-S2.H

Molecular Weight

  • 1026.02
 
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Names and Synonyms

Results Name

  • EINECS 277-096-8

Synonyms

  • Chromate(1-), bis(2,4-dihydro-4-((2-hydroxy-5-(2,2-dimethylpropyl)-3-nitrophenyl)azo)-5-methyl-2-(3-(aminosulfonyl)phenyl)-3H-pyrazol-3-onato(2-))-, hydrogen
  • EINECS 277-096-8

Systematic Names

  • Chromate(1-), bis(3-(4-((5-(2,2-dimethylpropyl)-2-(hydroxy-kappaO)-3-nitrophenyl)azo-kappaN1)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)benzenesulfonamidato(2-))-, hydrogen
  • Chromate(1-), bis(3-(4-(2-(5-(2,2-dimethylpropyl)-2-(hydroxy-kappaO)-3-nitrophenyl)diazenyl-kappaN1)-4,5-dihydro-3-methyl-5-(oxo-kappaO)-1H-pyrazol-1-yl)benzenesulfonamidato(2-))-, hydrogen (1:1)
  • Hydrogen bis(3-(4-((2-hydroxy-5-isobutyl-3-nitrophenyl)azo)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)benzene-1-sulphonamidato(2-))chromate(1-)

Registry Numbers

CAS Registry Number

  • 72928-86-0

System Generated Number

  • 0072928860

Molecular Formulas

Molecular Formula

  • C42-H44-Cr-N12-O12-S2.H

Molecular Formula Fragments

  • C42-H44-Cr-N12-O12-S2
  • COMPONENT
  • H

Structure Descriptors

InChI

1S/2C21H23N6O6S.Cr/c2*1-12-18(20(29)26(25-12)14-6-5-7-15(10-14)34(22,32)33)24-23-16-8-13(11-21(2,3)4)9-17(19(16)28)27(30)31;/h2*5-10,28H,11H2,1-4H3,(H2,22,32,33);/q2*-1;+3/p-1/b2*24-23+;

InChIKey

NYWRPTNOQLMKFW-GQPWVPPYSA-M

Smiles

[Cr+3].c1(N2N=C([C@@-](\N=N\c3c(c(cc(c3)CC(C)(C)C)[N+]([O-])=O)[O-])C2=O)C)cc(ccc1)S(=O)(=O)N.c1(cccc(c1)S(N)(=O)=O)N1N=C([C@@-](C1=O)\N=N\c1c(c(cc(c1)CC(C)(C)C)[N+]([O-])=O)[O-])C