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Substance Name: 1,4,7,10-Tetraazacyclododecane, 1,4,7-tris((4-methylphenyl)sulfonyl)-10-(methylsulfonyl)-
RN: 99892-20-3
InChIKey: RJMQVHXXWWNHDB-UHFFFAOYSA-N

Molecular Formula

  • C30-H40-N4-O8-S4

Molecular Weight

  • 712.93
 
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Names and Synonyms

  • 1,4,7,10-Tetraazacyclododecane, 1,4,7-tris((4-methylphenyl)sulfonyl)-10-(methylsulfonyl)-

Registry Numbers

CAS Registry Number

  • 99892-20-3

System Generated Number

  • 0099892203

Structure Descriptors

InChI

1S/C30H40N4O8S4/c1-25-5-11-28(12-6-25)44(37,38)32-19-17-31(43(4,35)36)18-20-33(45(39,40)29-13-7-26(2)8-14-29)22-24-34(23-21-32)46(41,42)30-15-9-27(3)10-16-30/h5-16H,17-24H2,1-4H3

InChIKey

RJMQVHXXWWNHDB-UHFFFAOYSA-N

Smiles

C1[N@@](CCN(CC[N@@](CCN(C1)S(=O)(=O)c1ccc(cc1)C)S(=O)(=O)c1ccc(cc1)C)S(=O)(=O)C)S(=O)(=O)c1ccc(cc1)C