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Substance Name: 2-(2-(1'-(2-(6-Chloro-2-methoxy-9-acridinyl)aminoethyl)(4,4'-bipiperidin)-1-yl)ethyl)-10-methoxy-7H-pyrido(4,3-c)carbazolium dimethanesulfonate
RN: 113794-21-1
InChIKey: IALCNOMNGQUJKA-DGBHBSGKSA-N

Molecular Weight

  • 956.02
 
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Names and Synonyms

  • 2-(2-(1'-(2-(6-Chloro-2-methoxy-9-acridinyl)aminoethyl)(4,4'-bipiperidin)-1-yl)ethyl)-10-methoxy-7H-pyrido(4,3-c)carbazolium dimethanesulfonate

Registry Numbers

CAS Registry Number

  • 113794-21-1

System Generated Number

  • 0113794211

Structure Descriptors

InChI

1S/C44H47ClN6O2.2CH4O3S.ClH/c1-52-33-5-9-39-36(26-33)43-38-28-51(21-15-31(38)3-8-41(43)47-39)24-23-50-19-13-30(14-20-50)29-11-17-49(18-12-29)22-16-46-44-35-7-4-32(45)25-42(35)48-40-10-6-34(53-2)27-37(40)44;2*1-5(2,3)4;/h3-10,15-16,21,23-27,29-30,39,41,47H,11-14,17-20,22,28H2,1-2H3;2*1H3,(H,2,3,4);1H/b24-23+,46-16+;;;

InChIKey

IALCNOMNGQUJKA-DGBHBSGKSA-N

Smiles

[NH2+]1[C@@H]2C=CC(OC)=CC2=C2C=3CN(C=CC3C=C[C@@H]12)\C=C\N1CCC(CC1)C1CCN(CC1)C\C=N\c1c2ccc(cc2nc2ccc(cc12)OC)Cl.[ClH-].OS(=O)(=O)C.OS(=O)(=O)C