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Substance Name: 1-Amino-4-(3-((dimethylamino)methyl)anilino)anthraquinone, compound with sulphuric acid (2:1)
RN: 83968-85-8
InChIKey: XZKFVOYKUWRVHZ-UHFFFAOYSA-N

Molecular Formula

  • C23-H21-N3-O2.1/2H2-O4-S

Molecular Weight

  • 840.9536
 
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Names and Synonyms

Synonym

  • EINECS 281-565-2

Systematic Name

  • 1-Amino-4-(3-((dimethylamino)methyl)anilino)anthraquinone, compound with sulphuric acid (2:1)

Registry Numbers

CAS Registry Number

  • 83968-85-8

System Generated Number

  • 0083968858

Molecular Formulas

Molecular Formula

  • C23-H21-N3-O2.1/2H2-O4-S

Molecular Formula Fragments

  • C23-H21-N3-O2
  • COMPONENT
  • H2-O4-S

Structure Descriptors

InChI

1S/2C23H21N3O2.H2O4S/c2*1-26(2)13-14-6-5-7-15(12-14)25-19-11-10-18(24)20-21(19)23(28)17-9-4-3-8-16(17)22(20)27;1-5(2,3)4/h2*3-12,25H,13,24H2,1-2H3;(H2,1,2,3,4)

InChIKey

XZKFVOYKUWRVHZ-UHFFFAOYSA-N

Smiles

CN(C)Cc1cccc(c1)Nc2ccc(c3c2C(=O)c4ccccc4C3=O)N.CN(C)Cc1cccc(c1)Nc2ccc(c3c2C(=O)c4ccccc4C3=O)N.OS(=O)(=O)O