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Substance Name: 12H-7,11-Nitrilo-6H-dibenzo(b,k)(1,4,7,10,13)pentaoxacycloeicosin, 9,20,22,23-tetrahydro-, compd. with (chloromethyl)oxirane (2:1)
RN: 74261-20-4
InChIKey: LLJNYWDKLDJBKK-UHFFFAOYSA-N

Molecular Formula

  • C23-H23-N-O5.1/2C3-H5-Cl-O

Molecular Weight

  • 879.398
 
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Names and Synonyms

  • 12H-7,11-Nitrilo-6H-dibenzo(b,k)(1,4,7,10,13)pentaoxacycloeicosin, 9,20,22,23-tetrahydro-, compd. with (chloromethyl)oxirane (2:1)
  • Oxirane, (chloromethyl)-, compd with 19,20,22,23-tetrahydro-12H-7,11-nitrilo-6H-dibenzo(b,k)(1,4,7,10,13)pentaoxacycloeicosin (1:2)

Registry Numbers

CAS Registry Number

  • 74261-20-4

System Generated Number

  • 0074261204

Molecular Formulas

Molecular Formula

  • C23-H23-N-O5.1/2C3-H5-Cl-O

Molecular Formula Fragments

  • C23-H23-N-O5
  • C3-H5-Cl-O
  • COMPONENT

Structure Descriptors

InChI

1S/2C23H23NO5.C3H5ClO/c2*1-3-10-22-20(8-1)26-14-12-25-13-15-27-21-9-2-4-11-23(21)29-17-19-7-5-6-18(24-19)16-28-22;4-1-3-2-5-3/h2*1-11H,12-17H2;3H,1-2H2

InChIKey

LLJNYWDKLDJBKK-UHFFFAOYSA-N

Smiles

C(Cl)[C@@H]1OC1.c1cccc2c1OCc1nc(COc3c(OCCOCCO2)cccc3)ccc1.c1cccc2c1OCc1nc(ccc1)COc1ccccc1OCCOCCO2