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Substance Name: Dihydrogen (ethyl)(4-(alpha-(4-(ethyl(3-sulphonatobenzyl)amino)-o-tolyl)-4-sulphonatobenzylidene)-3-methylcyclohexa-2,5-dien-1-ylidene)(3-sulphonatobenzyl)ammonium
RN: 93917-96-5
InChIKey: HNUMDFDFKDUHMA-UHFFFAOYSA-N

Molecular Formula

  • C39-H40-N2-O9-S3

Molecular Weight

  • 776.948
 
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Names and Synonyms

Synonym

  • EINECS 299-877-2

Systematic Name

  • Dihydrogen (ethyl)(4-(alpha-(4-(ethyl(3-sulphonatobenzyl)amino)-o-tolyl)-4-sulphonatobenzylidene)-3-methylcyclohexa-2,5-dien-1-ylidene)(3-sulphonatobenzyl)ammonium

Registry Numbers

CAS Registry Number

  • 93917-96-5

System Generated Number

  • 0093917965

Structure Descriptors

InChI

1S/C39H40N2O9S3/c1-5-40(25-29-9-7-11-35(23-29)52(45,46)47)32-15-19-37(27(3)21-32)39(31-13-17-34(18-14-31)51(42,43)44)38-20-16-33(22-28(38)4)41(6-2)26-30-10-8-12-36(24-30)53(48,49)50/h7-24H,5-6,25-26H2,1-4H3,(H2-,42,43,44,45,46,47,48,49,50)

InChIKey

HNUMDFDFKDUHMA-UHFFFAOYSA-N