Quinine 1-oxide

CAS Registry Number®

109906-48-1
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CAS Name

Quinine 1-oxide

Molecular Formula

C20H24N2O3

Molecular Mass

340.42

Cite this Page

Quinine 1-oxide.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=109906-48-1 (retrieved 2024-04-27) (CAS RN: 109906-48-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    195-196 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C20H24N2O3/c1-3-13-12-22(24)9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(25-2)11-17(16)18/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3/t13-,14-,19-,20+,22+/m0/s1

InChIKey

InChIKey=WVDIZKMXQMCCAA-CURGQOQWSA-N

SMILES

[C@H](O)([C@]1(N2(=O)C[C@H](C=C)[C@](C1)(CC2)[H])[H])C=3C4=C(C=CC(OC)=C4)N=CC3

Canonical SMILES

O=N12CCC(CC1C(O)C=3C=CN=C4C=CC(OC)=CC43)C(C=C)C2

Other Names for this Substance

  • Cinchonan-9-ol, 6′-methoxy-, 1-oxide, (8α,9R)-
  • Quinine 1-oxide

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