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Substance Name: 2-Chloro-N,N-dimethylthioxanthene-.delta.9,gamma-propylamine citrate
RN: 14241-35-1
InChIKey: VLSAIYYYWWMOOQ-KIUKIJHYSA-N

Molecular Formula

  • C18-H18-Cl-N-S.x-C6-H8-O7

Molecular Weight

  • 507.9884
 
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Names and Synonyms

Synonym

  • EINECS 238-116-0

Systematic Name

  • 2-Chloro-N,N-dimethylthioxanthene-.delta.9,gamma-propylamine citrate

Registry Numbers

CAS Registry Number

  • 14241-35-1

System Generated Number

  • 0014241351

Molecular Formulas

Molecular Formula

  • C18-H18-Cl-N-S.x-C6-H8-O7

Molecular Formula Fragments

  • C18-H18-Cl-N-S
  • C6-H8-O7
  • COMPONENT

Structure Descriptors

InChI

1S/C18H18ClNS.C6H8O7/c1-20(2)11-5-7-14-15-6-3-4-8-17(15)21-18-10-9-13(19)12-16(14)18;7-3(8)1-6(13,5(11)12)2-4(9)10/h3-4,6-10,12H,5,11H2,1-2H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/b14-7-;

InChIKey

VLSAIYYYWWMOOQ-KIUKIJHYSA-N

Smiles

CN(C)CC/C=C\1/c2ccccc2Sc3c1cc(cc3)Cl.C(C(=O)O)C(CC(=O)O)(C(=O)O)O