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Substance Name: 2-(5-((2-(Acetoxy)ethyl)sulphonyl)-2-methoxyphenyl)-2,4-dihydro-5-methyl-4-((4-methyl-2-nitrophenyl)azo)-3H-pyrazol-3-one
RN: 85750-10-3
InChIKey: YCPGPBLERLNEKN-WCWDXBQESA-N

Molecular Formula

  • C22-H23-N5-O8-S

Molecular Weight

  • 517.5167
 
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Names and Synonyms

Synonym

  • EINECS 288-535-8

Systematic Name

  • 2-(5-((2-(Acetoxy)ethyl)sulphonyl)-2-methoxyphenyl)-2,4-dihydro-5-methyl-4-((4-methyl-2-nitrophenyl)azo)-3H-pyrazol-3-one

Registry Numbers

CAS Registry Number

  • 85750-10-3

System Generated Number

  • 0085750103

Structure Descriptors

InChI

1S/C22H23N5O8S/c1-13-5-7-17(18(11-13)27(30)31)23-24-21-14(2)25-26(22(21)29)19-12-16(6-8-20(19)34-4)36(32,33)10-9-35-15(3)28/h5-8,11-12,21H,9-10H2,1-4H3/b24-23+

InChIKey

YCPGPBLERLNEKN-WCWDXBQESA-N

Smiles

Cc1ccc(c(c1)[N+](=O)[O-])/N=N/C2C(=NN(C2=O)c3cc(ccc3OC)S(=O)(=O)CCOC(=O)C)C