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Substance Name: 3,10-Bis((4-amino-3-sulphophenyl)amino)-6,13-dichlorotriphenodioxazine-4,11-disulphonic acid
RN: 42783-21-1
InChIKey: LKJYEFYOHSCHFC-UHFFFAOYSA-N

Molecular Formula

  • C30-H20-Cl2-N6-O14-S4

Molecular Weight

  • 887.686
 
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Names and Synonyms

Synonym

  • EINECS 255-941-1

Systematic Name

  • 3,10-Bis((4-amino-3-sulphophenyl)amino)-6,13-dichlorotriphenodioxazine-4,11-disulphonic acid

Registry Numbers

CAS Registry Number

  • 42783-21-1

System Generated Number

  • 0042783211

Structure Descriptors

InChI

1S/C30H20Cl2N6O14S4/c31-21-24-28(52-26-16(38-24)6-8-18(30(26)56(48,49)50)36-12-2-4-14(34)20(10-12)54(42,43)44)22(32)23-27(21)51-25-15(37-23)5-7-17(29(25)55(45,46)47)35-11-1-3-13(33)19(9-11)53(39,40)41/h1-10,35-36H,33-34H2,(H,39,40,41)(H,42,43,44)(H,45,46,47)(H,48,49,50)

InChIKey

LKJYEFYOHSCHFC-UHFFFAOYSA-N

Smiles

c12c(=Nc3c(O2)c(c(cc3)Nc2ccc(c(c2)S(=O)(=O)O)N)S(=O)(=O)O)c(c2c(=Nc3c(O2)c(c(cc3)Nc2ccc(c(c2)S(=O)(=O)O)N)S(=O)(=O)O)c1Cl)Cl