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Substance Name: Piperidine, 4-(7-fluoro-2-methoxy-11H-dibenz(b,e)(1,4)oxathiepin-11-yl)-1-methyl-, (Z)-2-butenedioate (1:1)
RN: 83975-62-6
InChIKey: CCMINDMJPZSHLZ-WLHGVMLRSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H22-F-N-O2-S.C4-H4-O4

Molecular Weight

  • 475.5344
 
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Names and Synonyms

Synonym

  • 2-Fluoro-8-methoxy-6-(1-methyl-4-piperidyl)-6H-dibenz(b,e)-1,4-oxathiepin maleate

Systematic Name

  • Piperidine, 4-(7-fluoro-2-methoxy-11H-dibenz(b,e)(1,4)oxathiepin-11-yl)-1-methyl-, (Z)-2-butenedioate (1:1)

Registry Numbers

CAS Registry Number

  • 83975-62-6

System Generated Number

  • 0083975626

Molecular Formulas

Molecular Formula

  • C20-H22-F-N-O2-S.C4-H4-O4

Molecular Formula Fragments

  • C20-H22-F-N-O2-S
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C20H22FNO2S.C4H4O4/c1-22-9-7-13(8-10-22)20-16-12-15(23-2)4-6-18(16)25-19-11-14(21)3-5-17(19)24-20;5-3(6)1-2-4(7)8/h3-6,11-13,20H,7-10H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1+

InChIKey

CCMINDMJPZSHLZ-WLHGVMLRSA-N

Smiles

CN1CCC(CC1)C2c3cc(ccc3Sc4cc(ccc4O2)F)OC.C(=C/C(=O)O)\C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 79400ug/kg (79.4mg/kg) BEHAVIORAL: REGIDITY Collection of Czechoslovak Chemical Communications. Vol. 47, Pg. 3114, 1982.
mouse LD50 oral 217mg/kg (217mg/kg) BEHAVIORAL: REGIDITY Collection of Czechoslovak Chemical Communications. Vol. 47, Pg. 3114, 1982.