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Substance Name: m,m'-((9,10-Dihydro-9,10-dioxo-1,4-anthrylene)diimino)bis(2,4,6-trimethylbenzenesulphonic) acid, compound with hexane-1,6-diamine (1:1)
RN: 79665-26-2
InChIKey: PAGCKSAVALMKPU-UHFFFAOYSA-N

Molecular Formula

  • C32-H30-N2-O8-S2.C6-H16-N2

Molecular Weight

  • 750.9334
 
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Names and Synonyms

Synonym

  • EINECS 279-213-8

Systematic Name

  • m,m'-((9,10-Dihydro-9,10-dioxo-1,4-anthrylene)diimino)bis(2,4,6-trimethylbenzenesulphonic) acid, compound with hexane-1,6-diamine (1:1)

Registry Numbers

CAS Registry Number

  • 79665-26-2

System Generated Number

  • 0079665262

Molecular Formulas

Molecular Formula

  • C32-H30-N2-O8-S2.C6-H16-N2

Molecular Formula Fragments

  • C32-H30-N2-O8-S2
  • C6-H16-N2
  • COMPONENT

Structure Descriptors

InChI

1S/C32H30N2O8S2.C6H16N2/c1-15-13-17(3)31(43(37,38)39)19(5)27(15)33-23-11-12-24(26-25(23)29(35)21-9-7-8-10-22(21)30(26)36)34-28-16(2)14-18(4)32(20(28)6)44(40,41)42;7-5-3-1-2-4-6-8/h7-14,33-34H,1-6H3,(H,37,38,39)(H,40,41,42);1-8H2

InChIKey

PAGCKSAVALMKPU-UHFFFAOYSA-N

Smiles

Cc1cc(c(c(c1Nc2ccc(c3c2C(=O)c4ccccc4C3=O)Nc5c(cc(c(c5C)S(=O)(=O)O)C)C)C)S(=O)(=O)O)C.C(CCCN)CCN