7-Benzofurancarboxamide, 5-chloro-2,3-dihydro-2,2-dimethyl-N-[(3-endo)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl]-, (2Z)-2-butenedioate (1:1)

CAS Registry Number®

123482-23-5
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CAS Name

7-Benzofurancarboxamide, 5-chloro-2,3-dihydro-2,2-dimethyl-N-[(3-endo)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl]-, (2Z)-2-butenedioate (1:1)

Molecular Formula

C19H25ClN2O2.C4H4O4

Cite this Page

7-Benzofurancarboxamide, 5-chloro-2,3-dihydro-2,2-dimethyl-N-[(3-endo)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl]-, (2Z)-2-butenedioate (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=123482-23-5 (retrieved 2024-05-06) (CAS RN: 123482-23-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    184-186 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1/C19H25ClN2O2.C4H4O4/c1-19(2)10-11-6-12(20)7-16(17(11)24-19)18(23)21-13-8-14-4-5-15(9-13)22(14)3;5-3(6)1-2-4(7)8/h6-7,13-15H,4-5,8-10H2,1-3H3,(H,21,23);1-2H,(H,5,6)(H,7,8)/b;2-1-/t13-,14+,15-;

InChIKey

InChIKey=HAFQATMFFHYNPN-QRPZPOMXNA-N

SMILES

C(N[C@H]1C[C@@]2(N(C)[C@](C1)(CC2)[H])[H])(=O)C3=C4C(CC(C)(C)O4)=CC(Cl)=C3.C(=C\C(O)=O)\C(O)=O

Canonical SMILES

O=C(O)C=CC(=O)O.O=C(NC1CC2N(C)C(CC2)C1)C3=CC(Cl)=CC4=C3OC(C)(C)C4

Other Names for this Substance

  • 7-Benzofurancarboxamide, 5-chloro-2,3-dihydro-2,2-dimethyl-N-[(3-endo)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl]-, (2Z)-2-butenedioate (1:1)
  • 7-Benzofurancarboxamide, 5-chloro-2,3-dihydro-2,2-dimethyl-N-(8-methyl-8-azabicyclo[3.2.1]oct-3-yl)-, endo-, (Z)-2-butenedioate (1:1)
  • LY 277359 maleate
  • Zatosetron maleate

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