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Substance Name: Dichloroacetylajmaline
RN: 2800-66-0
InChIKey: XZIPNZUGJSZRCQ-IEHLMEBJSA-N

Molecular Weight

  • 479.401
 
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Names and Synonyms

Name of Substance

  • Dichloroacetylajmaline

Systematic Name

  • Ajmalan-17,21-diol, bis(chloroacetate) (ester), (17R,21alpha)-

Registry Numbers

CAS Registry Number

  • 2800-66-0

System Generated Number

  • 0002800660

Structure Descriptors

InChI

1S/C24H28Cl2N2O4/c1-3-12-13-8-16-21-24(14-6-4-5-7-15(14)27(21)2)9-17(20(13)22(24)31-18(29)10-25)28(16)23(12)32-19(30)11-26/h4-7,12-13,16-17,20-23H,3,8-11H2,1-2H3/t12-,13?,16-,17-,20?,21-,22+,23+,24?/m0/s1

InChIKey

XZIPNZUGJSZRCQ-IEHLMEBJSA-N

Smiles

O([C@H]1[N@@]2[C@H]3C[C@@]45c6ccccc6N(C)[C@@H]4[C@@H]2C[C@@H]([C@@H]1CC)[C@@H]3[C@H]5OC(CCl)=O)C(=O)CCl