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Substance Name: 1,7-Naphthalenedisulfonic acid, 4,4'-(carbonylbis(imino(1-methyl-1H-pyrrole-4,2-diyl)carbonylimino(1-methyl-1H-pyrrole-4,2-diyl)carbonylimino))bis-
RN: 208576-37-8
InChIKey: JENQYCHCYPVWHE-UHFFFAOYSA-N

Molecular Formula

  • C45-H40-N10-O17-S4

Molecular Weight

  • 1121.128
 
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Names and Synonyms

  • 1,7-Naphthalenedisulfonic acid, 4,4'-(carbonylbis(imino(1-methyl-1H-pyrrole-4,2-diyl)carbonylimino(1-methyl-1H-pyrrole-4,2-diyl)carbonylimino))bis-

Registry Numbers

CAS Registry Number

  • 208576-37-8

System Generated Number

  • 0208576378

Structure Descriptors

InChI

1S/C45H40N10O17S4/c1-52-19-23(13-37(52)43(58)50-33-9-11-39(75(67,68)69)31-17-27(73(61,62)63)5-7-29(31)33)46-41(56)35-15-25(21-54(35)3)48-45(60)49-26-16-36(55(4)22-26)42(57)47-24-14-38(53(2)20-24)44(59)51-34-10-12-40(76(70,71)72)32-18-28(74(64,65)66)6-8-30(32)34/h5-22H,1-4H3,(H,46,56)(H,47,57)(H,50,58)(H,51,59)(H2,48,49,60)(H,61,62,63)(H,64,65,66)(H,67,68,69)(H,70,71,72)

InChIKey

JENQYCHCYPVWHE-UHFFFAOYSA-N

Smiles

Cn1cc(cc1C(=O)Nc2ccc(c3c2ccc(c3)S(=O)(=O)O)S(=O)(=O)O)NC(=O)c4cc(cn4C)NC(=O)Nc5cc(n(c5)C)C(=O)Nc6cc(n(c6)C)C(=O)Nc7ccc(c8c7ccc(c8)S(=O)(=O)O)S(=O)(=O)O