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Substance Name: Hydrogen (29H,31H-phthalocyanine-2-sulphonato(3-)-N29,N30,N31,N32)cuprate(1-), compound with octadecylamine (1:1)
RN: 85085-84-3
InChIKey: GIIQVVIBALXZEO-UHFFFAOYSA-N

Molecular Formula

  • C32-H15-Cu-N8-O3-S.C18-H39-N.H

Molecular Weight

  • 925.6565
 
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Names and Synonyms

Synonym

  • EINECS 285-403-1

Systematic Name

  • Hydrogen (29H,31H-phthalocyanine-2-sulphonato(3-)-N29,N30,N31,N32)cuprate(1-), compound with octadecylamine (1:1)

Registry Numbers

CAS Registry Number

  • 85085-84-3

System Generated Number

  • 0085085843

Molecular Formulas

Molecular Formula

  • C32-H15-Cu-N8-O3-S.C18-H39-N.H

Molecular Formula Fragments

  • C18-H39-N
  • C32-H15-Cu-N8-O3-S
  • COMPONENT
  • H

Structure Descriptors

InChI

1S/C32H16N8O3S.C18H39N.Cu/c41-44(42,43)16-13-14-23-24(15-16)32-39-30-22-12-6-5-11-21(22)28(37-30)35-26-18-8-2-1-7-17(18)25(33-26)34-27-19-9-3-4-10-20(19)29(36-27)38-31(23)40-32;1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19;/h1-15H,(H-2,33,34,35,36,37,38,39,40,41,42,43);2-19H2,1H3;/q-2;;+2

InChIKey

GIIQVVIBALXZEO-UHFFFAOYSA-N

Smiles

CCCCCCCCCCCCCCCCCCN.O=S1(=O)O[Cu-]2N3\C\4=N/C5=N\C(=N/c6c7ccccc7c(\N=C\8/N=C(\N=C/3\c9ccccc49)c%10ccc1cc8%10)n26)\c%11ccccc5%11