Vernakalant hydrochloride

CAS Registry Number®

748810-28-8

CAS Name

Vernakalant hydrochloride

Molecular Formula

C20H31NO4.ClH

Cite this Page

Vernakalant hydrochloride.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=748810-28-8 (retrieved 2024-11-21) (CAS RN: 748810-28-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    152-154 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C20H31NO4.ClH/c1-23-19-8-7-15(13-20(19)24-2)10-12-25-18-6-4-3-5-17(18)21-11-9-16(22)14-21;/h7-8,13,16-18,22H,3-6,9-12,14H2,1-2H3;1H/t16-,17-,18-;/m1./s1

InChIKey

InChIKey=JMHYCBFEEFHTMK-IIUXMCBISA-N

SMILES

O(CCC1=CC(OC)=C(OC)C=C1)[C@H]2[C@@H](CCCC2)N3CC[C@@H](O)C3.Cl

Canonical SMILES

Cl.OC1CN(CC1)C2CCCCC2OCCC3=CC=C(OC)C(OC)=C3

Other Names for this Substance

  • 3-Pyrrolidinol, 1-[(1R,2R)-2-[2-(3,4-dimethoxyphenyl)ethoxy]cyclohexyl]-, hydrochloride (1:1), (3R)-
  • 3-Pyrrolidinol, 1-[(1R,2R)-2-[2-(3,4-dimethoxyphenyl)ethoxy]cyclohexyl]-, hydrochloride, (3R)-
  • (1R,2R)-2-((3R)-Hydroxypyrrolidinyl)-1-[2-(3,4-dimethoxyphenyl)ethoxy]cyclohexane monohydrochloride
  • Vernakalant hydrochloride
  • RSD 1235

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Deleted or Replaced CAS Registry Numbers

605683-48-5

CAS INSIGHTSTM
Targeted protein degrader structure, illustration