Cinchonan-9-ol, 6′-methoxy-, 9-benzoate, (9S)-

CAS Registry Number®

60723-45-7
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CAS Name

Cinchonan-9-ol, 6′-methoxy-, 9-benzoate, (9S)-

Molecular Formula

C27H28N2O3

Molecular Mass

428.52

Cite this Page

Cinchonan-9-ol, 6′-methoxy-, 9-benzoate, (9S)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=60723-45-7 (retrieved 2024-08-10) (CAS RN: 60723-45-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C27H28N2O3/c1-3-18-17-29-14-12-20(18)15-25(29)26(32-27(30)19-7-5-4-6-8-19)22-11-13-28-24-10-9-21(31-2)16-23(22)24/h3-11,13,16,18,20,25-26H,1,12,14-15,17H2,2H3/t18-,20-,25+,26-/m0/s1

InChIKey

InChIKey=UOXLNYIYPISSFF-LXFCCGDJSA-N

SMILES

[C@@H](OC(=O)C1=CC=CC=C1)([C@@]2([N@@]3C[C@H](C=C)[C@](C2)(CC3)[H])[H])C=4C5=C(C=CC(OC)=C5)N=CC4

Canonical SMILES

O=C(OC(C=1C=CN=C2C=CC(OC)=CC21)C3N4CCC(C3)C(C=C)C4)C=5C=CC=CC5

Other Names for this Substance

  • Cinchonan-9-ol, 6′-methoxy-, 9-benzoate, (9S)-
  • Cinchonan-9-ol, 6′-methoxy-, benzoate (ester), (9S)-
  • Quinidine benzoate
  • Benzoylquinidine

Deleted or Replaced CAS Registry Numbers

1528765-00-5