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Substance Name: 3,4',4'',4'''-Tetrasulfonyl copper phthalocyanine, tetra sodium salt
RN: 123439-80-5
InChIKey: CMYOSIPFSOPTRC-UHFFFAOYSA-N

Molecular Formula

  • C32-H16-N8-O12-S4.Cu

Molecular Weight

  • 896.3324
 
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Names and Synonyms

  • 3,4',4'',4'''-Tetrasulfonyl copper phthalocyanine, tetra sodium salt

Registry Numbers

CAS Registry Number

  • 123439-80-5

System Generated Number

  • 0123439805

Molecular Formulas

Molecular Formula

  • C32-H16-N8-O12-S4.Cu

Molecular Formula Fragments

  • C32-H16-N8-O12-S4
  • COMPONENT
  • Cu

Structure Descriptors

InChI

1S/C32H16N8O12S4.Cu/c41-53(42,43)13-4-7-16-20(10-13)29-33-25(16)35-30-22-12-15(55(47,48)49)6-9-18(22)27(37-30)39-32-24-19(2-1-3-23(24)56(50,51)52)28(40-32)38-31-21-11-14(54(44,45)46)5-8-17(21)26(34-29)36-31;/h1-12H,(H4-2,33,34,35,36,37,38,39,40,41,42,43,44,45,46,47,48,49,50,51,52);/q-2;+2

InChIKey

CMYOSIPFSOPTRC-UHFFFAOYSA-N

Smiles

c1cc\2c(c(c1)S(=O)(=O)O)c3/[n-]/c2n\c-4n/c(n\c5c6cc(ccc6c([n-]5)/nc/7\nc(\n3)-c8c7cc(cc8)S(=O)(=O)O)S(=O)(=O)O)/c9c4cc(cc9)S(=O)(=O)O.[Cu+2]