8-Azoniabicyclo[3.2.1]octane, 8-[(4-butoxyphenyl)methyl]-3-[(2S)-3-hydroxy-1-oxo-2-phenylpropoxy]-8-methyl-, bromide (1:1), (3-endo)-

CAS Registry Number®

29025-14-7
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CAS Name

8-Azoniabicyclo[3.2.1]octane, 8-[(4-butoxyphenyl)methyl]-3-[(2S)-3-hydroxy-1-oxo-2-phenylpropoxy]-8-methyl-, bromide (1:1), (3-endo)-

Molecular Formula

C28H38NO4.Br

Cite this Page

8-Azoniabicyclo[3.2.1]octane, 8-[(4-butoxyphenyl)methyl]-3-[(2S)-3-hydroxy-1-oxo-2-phenylpropoxy]-8-methyl-, bromide (1:1), (3-endo)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=29025-14-7 (retrieved 2024-04-29) (CAS RN: 29025-14-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    166-168 °C

Source(s)

  • (1) Drugs - Synonyms and Properties data were obtained from Ashgate Publishing Co. (US)

Other Names and Identifiers

InChI

InChI=1S/C28H38NO4.BrH/c1-3-4-16-32-25-14-10-21(11-15-25)19-29(2)23-12-13-24(29)18-26(17-23)33-28(31)27(20-30)22-8-6-5-7-9-22;/h5-11,14-15,23-24,26-27,30H,3-4,12-13,16-20H2,1-2H3;1H/q+1;/p-1/t23-,24+,26+,27-,29?;/m1./s1

InChIKey

InChIKey=JABDOYKGZCPHPX-XSCYYCMVSA-M

SMILES

C([N+]1(C)[C@@]2(C[C@@H](OC([C@H](CO)C3=CC=CC=C3)=O)C[C@]1(CC2)[H])[H])C4=CC=C(OCCCC)C=C4.[Br-]

Canonical SMILES

[Br-].O=C(OC1CC2CCC(C1)[N+]2(C)CC3=CC=C(OCCCC)C=C3)C(C=4C=CC=CC4)CO

Other Names for this Substance

  • 8-Azoniabicyclo[3.2.1]octane, 8-[(4-butoxyphenyl)methyl]-3-[(2S)-3-hydroxy-1-oxo-2-phenylpropoxy]-8-methyl-, bromide (1:1), (3-endo)-
  • 1αH,5αH-Tropanium, 8-(p-butoxybenzyl)-3α-hydroxy-, bromide, (-)-tropate
  • 8-Azoniabicyclo[3.2.1]octane, 8-[(4-butoxyphenyl)methyl]-3-(3-hydroxy-1-oxo-2-phenylpropoxy)-8-methyl-, bromide, [3(S)-endo]-
  • N-(Butoxybenzyl)hyoscyamine bromide
  • (p-Butoxybenzyl)hyoscyaminium bromide

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