1-Butanone, 1-[2-[3-[(1,1-dimethylethyl)amino]-2-hydroxypropoxy]-5-fluorophenyl]-, (2Z)-2-butenedioate (1:1) (salt)

CAS Registry Number®

88606-96-6

CAS Name

1-Butanone, 1-[2-[3-[(1,1-dimethylethyl)amino]-2-hydroxypropoxy]-5-fluorophenyl]-, (2Z)-2-butenedioate (1:1) (salt)

Molecular Formula

C17H26FNO3.C4H4O4

Cite this Page

1-Butanone, 1-[2-[3-[(1,1-dimethylethyl)amino]-2-hydroxypropoxy]-5-fluorophenyl]-, (2Z)-2-butenedioate (1:1) (salt).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=88606-96-6 (retrieved 2024-11-26) (CAS RN: 88606-96-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C17H26FNO3.C4H4O4/c1-5-6-15(21)14-9-12(18)7-8-16(14)22-11-13(20)10-19-17(2,3)4;5-3(6)1-2-4(7)8/h7-9,13,19-20H,5-6,10-11H2,1-4H3;1-2H,(H,5,6)(H,7,8)/b;2-1-

InChIKey

InChIKey=XAFHIGHFTQNWCF-BTJKTKAUSA-N

SMILES

C(CCC)(=O)C1=C(OCC(CNC(C)(C)C)O)C=CC(F)=C1.C(=C\C(O)=O)\C(O)=O

Canonical SMILES

O=C(O)C=CC(=O)O.O=C(C1=CC(F)=CC=C1OCC(O)CNC(C)(C)C)CCC

Other Names for this Substance

  • 1-Butanone, 1-[2-[3-[(1,1-dimethylethyl)amino]-2-hydroxypropoxy]-5-fluorophenyl]-, (2Z)-2-butenedioate (1:1) (salt)
  • 1-Butanone, 1-[2-[3-[(1,1-dimethylethyl)amino]-2-hydroxypropoxy]-5-fluorophenyl]-, (±)-, (Z)-2-butenedioate (1:1) (salt)
  • Cafide
  • Butofilolol maleate
  • 1-[5-Fluoro-2-[2-hydroxy-3-(tert-butylamino)propoxy]phenyl]butan-1-one maleate

CAS INSIGHTSTM
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