Cinchonan-9-ol, 6′-methoxy-, (8α,9R)-, monobenzoate (salt)

CAS Registry Number®

750-88-9

CAS Name

Cinchonan-9-ol, 6′-methoxy-, (8α,9R)-, monobenzoate (salt)

Molecular Formula

C20H24N2O2.C7H6O2

Cite this Page

Cinchonan-9-ol, 6′-methoxy-, (8α,9R)-, monobenzoate (salt).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=750-88-9 (retrieved 2025-01-07) (CAS RN: 750-88-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C20H24N2O2.C7H6O2/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18;8-7(9)6-4-2-1-3-5-6/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;1-5H,(H,8,9)/t13-,14-,19-,20+;/m0./s1

InChIKey

InChIKey=AQHKBFWCAHXPDT-DSXUQNDKSA-N

SMILES

[C@@H](O)(C=1C2=C(C=CC(OC)=C2)N=CC1)[C@]3([N@@]4C[C@H](C=C)[C@](C3)(CC4)[H])[H].C(O)(=O)C1=CC=CC=C1

Canonical SMILES

O=C(O)C=1C=CC=CC1.OC(C=1C=CN=C2C=CC(OC)=CC21)C3N4CCC(C3)C(C=C)C4

Other Names for this Substance

  • Cinchonan-9-ol, 6′-methoxy-, (8α,9R)-, monobenzoate (salt)
  • Quinine, monobenzoate (salt)

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