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Substance Name: 2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-9,10-dioxo-4-((3-((1-oxopropyl)amino)phenyl)amino)-, compd. with 1,1',1''-nitrilotris(2-propanol) (1:1)
RN: 186032-38-2
InChIKey: FFMYNGMORMQARV-UHFFFAOYSA-N

Classification Code

  • TSCA Flag PMN (a Commenced PMN (Premanufacture Notice) Substance)

Molecular Formula

  • C23-H19-N3-O6-S.C9-H21-N-O3

Molecular Weight

  • 656.753
 
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Names and Synonyms

  • 2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-9,10-dioxo-4-((3-((1-oxopropyl)amino)phenyl)amino)-, compd. with 1,1',1''-nitrilotris(2-propanol) (1:1)

Registry Numbers

CAS Registry Number

  • 186032-38-2

System Generated Number

  • 0186032382

Structure Descriptors

InChI

1S/C23H19N3O6S.C9H21NO3/c1-2-18(27)26-13-7-5-6-12(10-13)25-16-11-17(33(30,31)32)21(24)20-19(16)22(28)14-8-3-4-9-15(14)23(20)29;1-7(11)4-10(5-8(2)12)6-9(3)13/h3-11,25H,2,24H2,1H3,(H,26,27)(H,30,31,32);7-9,11-13H,4-6H2,1-3H3

InChIKey

FFMYNGMORMQARV-UHFFFAOYSA-N

Smiles

CCC(=O)Nc1cccc(Nc2cc(c(N)c3C(=O)c4ccccc4C(=O)c23)S(=O)(=O)O)c1.CC(O)CN(CC(C)O)CC(C)O