Cinchonan-9-ol, 10,11-dihydro-6′-methoxy-, 9-(4-chlorobenzoate), (8α,9R)-
CAS Registry Number®
113216-88-9
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CAS Name
Cinchonan-9-ol, 10,11-dihydro-6′-methoxy-, 9-(4-chlorobenzoate), (8α,9R)-Molecular Formula
C27H29ClN2O3Molecular Mass
464.98Cite this Page
Cinchonan-9-ol, 10,11-dihydro-6′-methoxy-, 9-(4-chlorobenzoate), (8α,9R)-. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=113216-88-9 (retrieved ) (CAS RN: 113216-88-9). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C27H29ClN2O3/c1-3-17-16-30-13-11-19(17)14-25(30)26(33-27(31)18-4-6-20(28)7-5-18)22-10-12-29-24-9-8-21(32-2)15-23(22)24/h4-10,12,15,17,19,25-26H,3,11,13-14,16H2,1-2H3/t17-,19-,25-,26+/m0/s1
InChIKey
InChIKey=TXVNNFDXQZFMBQ-MFQNCIFPSA-N
SMILES
[C@H](OC(=O)C1=CC=C(Cl)C=C1)([C@]2([N@@]3C[C@H](CC)[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(C4)CC)C5=CC=C(Cl)C=C5
Other Names for this Substance
- Cinchonan-9-ol, 10,11-dihydro-6′-methoxy-, 9-(4-chlorobenzoate), (8α,9R)-
- Cinchonan-9-ol, 10,11-dihydro-6′-methoxy-, 4-chlorobenzoate (ester), (8α,9R)-
- 10,11-Dihydroquinine p-chlorobenzoate
- Hydroquinine p-chlorobenzoate
- Hydroquinine 4-chlorobenzoate
Deleted or Replaced CAS Registry Numbers
352525-20-3
