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Substance Name: (4-((4-(Bis((3-sulphophenyl)methyl)amino)phenyl)(4-(dimethylamino)phenyl)methylene)-2,5-cyclohexadien-1-ylidene)dimethylammonium
RN: 25329-62-8
InChIKey: ZSGFDSIAGRPBLU-UHFFFAOYSA-N

Molecular Formula

  • C37-H37-N3-O6-S2

Molecular Weight

  • 700.877
 
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Names and Synonyms

Synonym

  • EINECS 246-851-3

Systematic Name

  • (4-((4-(Bis((3-sulphophenyl)methyl)amino)phenyl)(4-(dimethylamino)phenyl)methylene)-2,5-cyclohexadien-1-ylidene)dimethylammonium

Registry Numbers

CAS Registry Number

  • 25329-62-8

System Generated Number

  • 0025329628

Structure Descriptors

InChI

1S/C37H40N4O6S2/c1-5-41(6-2)23-21-39(22-24-41)37(31-13-17-33(18-14-31)38(3)4)32-15-19-34(20-16-32)40(27-29-9-7-11-35(25-29)48(42,43)44)28-30-10-8-12-36(26-30)49(45,46)47/h7-26H,5-6,27-28H2,1-4H3

InChIKey

ZSGFDSIAGRPBLU-UHFFFAOYSA-N

Smiles

CC[N+]1(C=C[N+](=C(c2ccc(cc2)N(C)C)c3ccc(cc3)N(Cc4cccc(c4)S(=O)(=O)[O-])Cc5cccc(c5)S(=O)(=O)[O-])C=C1)CC