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Substance Name: 1-(3-(Acetoxy)propyl)-2-(3-(1-(3-(acetoxy)propyl)-5,6-dichloro-3-ethyl-1,3-dihydro-2H-benzimidazol-2-ylidene)-1-propenyl)-5,6-dichloro-3-ethyl-1H-benzimidazolium iodide
RN: 51829-30-2
InChIKey: HYLRUFVMURJYFP-UHFFFAOYSA-M

Molecular Formula

  • C31-H35-Cl4-N4-O4.I

Molecular Weight

  • 796.3535
 
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Names and Synonyms

Synonym

  • EINECS 257-459-7

Systematic Name

  • 1-(3-(Acetoxy)propyl)-2-(3-(1-(3-(acetoxy)propyl)-5,6-dichloro-3-ethyl-1,3-dihydro-2H-benzimidazol-2-ylidene)-1-propenyl)-5,6-dichloro-3-ethyl-1H-benzimidazolium iodide

Registry Numbers

CAS Registry Number

  • 51829-30-2

System Generated Number

  • 0051829302

Molecular Formulas

Molecular Formula

  • C31-H35-Cl4-N4-O4.I

Molecular Formula Fragments

  • C31-H35-Cl4-N4-O4
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C31H35Cl4N4O4.HI/c1-5-36-26-16-22(32)24(34)18-28(26)38(12-8-14-42-20(3)40)30(36)10-7-11-31-37(6-2)27-17-23(33)25(35)19-29(27)39(31)13-9-15-43-21(4)41;/h7,10-11,16-19H,5-6,8-9,12-15H2,1-4H3;1H/q+1;/p-1

InChIKey

HYLRUFVMURJYFP-UHFFFAOYSA-M

Smiles

CC[n+]1c2cc(c(cc2n(c1/C=C/C=C\3/N(c4cc(c(cc4N3CCCOC(=O)C)Cl)Cl)CC)CCCOC(=O)C)Cl)Cl.[I-]