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Substance Name: Mirisetron maleate [USAN]
RN: 148611-75-0
UNII: 0B4615FL1S
InChIKey: OQIHDZMOAKTHKW-HNJJWOJJSA-N

Classification Codes

  • Anti-Anxiety Agent
  • Anti-Anxiety Agents

Molecular Formula

  • C24-H31-N3-O2.C4-H4-O4

Molecular Weight

  • 509.599
 
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Names and Synonyms

Name of Substance

  • Mirisetron maleate
  • Mirisetron maleate [USAN]

Synonyms

  • 1-Cyclohexyl-1,4-dihydro-4-oxo-N-1alphaH,5alphaH-tropan-3alpha-yl-3-quinolinecarboxamide maleate (1:1)
  • 3-Quinolinecarboxamide, 1-cyclohexyl-1,4-dihydro-N-(8-methyl-8-azabicyclo(3.2.1)oct-3-yl)-4-oxo-, endo-, (Z)-2-butenedioate (1:1)
  • Mirisetron maleate
  • UNII-0B4615FL1S
  • WAY-SEC-579

Systematic Name

  • 3-Quinolinecarboxamide, 1-cyclohexyl-1,4-dihydro-N-(8-methyl-8-azabicyclo(3.2.1)oct-3-yl)-4-oxo-, endo-, (Z)-2-butenedioate (1:1)

Registry Numbers

CAS Registry Number

  • 148611-75-0

FDA UNII

  • 0B4615FL1S

System Generated Number

  • 0148611750

Molecular Formulas

Molecular Formula

  • C24-H31-N3-O2.C4-H4-O4

Molecular Formula Fragments

  • C24-H31-N3-O2
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C24H31N3O2.C4H4O4/c1-26-18-11-12-19(26)14-16(13-18)25-24(29)21-15-27(17-7-3-2-4-8-17)22-10-6-5-9-20(22)23(21)28;5-3(6)1-2-4(7)8/h5-6,9-10,15-19H,2-4,7-8,11-14H2,1H3,(H,25,29);1-2H,(H,5,6)(H,7,8)/b;2-1-/t16-,18+,19-;

InChIKey

OQIHDZMOAKTHKW-HNJJWOJJSA-N

Smiles

n1(c2c(c(c(c1)C(=O)N[C@H]1C[C@@H]3N(C)[C@H](C1)CC3)=O)cccc2)C1CCCCC1.C(=C/C(=O)O)\C(=O)O