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Substance Name: 3'-Thymidylic acid, 5'-O-(bis(4-methoxyphenyl)phenylmethyl)-, mono(4-chlorophenyl) ester, compd. with N,N-diethylethanamine (1:1)
RN: 65062-61-5
InChIKey: LAKJKVUHWWKNHX-CFNLNGMWSA-N

Molecular Formula

  • C37-H36-Cl-N2-O10-P.C6-H15-N

Molecular Weight

  • 836.3139
 
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Names and Synonyms

Synonym

  • EINECS 265-360-5

Systematic Name

  • 3'-Thymidylic acid, 5'-O-(bis(4-methoxyphenyl)phenylmethyl)-, mono(4-chlorophenyl) ester, compd. with N,N-diethylethanamine (1:1)

Registry Numbers

CAS Registry Number

  • 65062-61-5

System Generated Number

  • 0065062615

Molecular Formulas

Molecular Formula

  • C37-H36-Cl-N2-O10-P.C6-H15-N

Molecular Formula Fragments

  • C37-H36-Cl-N2-O10-P
  • C6-H15-N
  • COMPONENT

Structure Descriptors

InChI

1S/C37H36ClN2O10P.C6H15N/c1-24-22-40(36(42)39-35(24)41)34-21-32(50-51(43,44)49-31-19-13-28(38)14-20-31)33(48-34)23-47-37(25-7-5-4-6-8-25,26-9-15-29(45-2)16-10-26)27-11-17-30(46-3)18-12-27;1-4-7(5-2)6-3/h4-20,22,32-34H,21,23H2,1-3H3,(H,43,44)(H,39,41,42);4-6H2,1-3H3/t32-,33+,34+;/m0./s1

InChIKey

LAKJKVUHWWKNHX-CFNLNGMWSA-N

Smiles

CCN(CC)CC.Cc1cn(c(=O)[nH]c1=O)[C@H]2C[C@@H]([C@H](O2)COC(c3ccccc3)(c4ccc(cc4)OC)c5ccc(cc5)OC)OP(=O)(O)Oc6ccc(cc6)Cl