| SpectraBase Spectrum ID |
7iILrxlUV7a |
| Name |
Acetic acid (S)-(5-benzofuran-2-yl-1-aza-bicyclo[2.2.2]oct-2-yl)-(6-methoxy-quinolin-4-yl)-methyl ester |
| Alternate Name(s) |
(3S,4S,8R,9S)-9-Acetoxy-3-benzofuryl-6'-methoxycinchonan
(S)-[5-(1-benzofuran-2-yl)-1-azabicyclo[2.2.2]oct-2-yl](6-methoxy-4-quinolinyl)methyl acetate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H28N2O4 |
| InChI |
InChI=1S/C28H28N2O4/c1-17(31)33-28(21-9-11-29-24-8-7-20(32-2)15-22(21)24)25-13-18-10-12-30(25)16-23(18)27-14-19-5-3-4-6-26(19)34-27/h3-9,11,14-15,18,23,25,28H,10,12-13,16H2,1-2H3/t18-,23-,25?,28+/m1/s1 |
| InChIKey |
DWPOQFIVGNBCEQ-PADLLJQOSA-N |
| Molecular Weight |
456.542 g/mol |
| SMILES |
c1([C@@]2(CN3CC[C@@]2(CC3[C@](c2c3c(ccc(c3)OC)ncc2)(OC(=O)C)[H])[H])[H])oc2ccccc2c1 |
| SPLASH |
splash10-004u-0940000000-ce7712ad0f2218e95751 |
| Source of Spectrum |
K-2001-57-21 |
| Wiley ID |
1578343 |
![Acetic acid (S)-(5-benzofuran-2-yl-1-aza-bicyclo[2.2.2]oct-2-yl)-(6-methoxy-quinolin-4-yl)-methyl ester](/api/spectrum/7iILrxlUV7a/structure.png?h=300&w=458 "Acetic acid (S)-(5-benzofuran-2-yl-1-aza-bicyclo[2.2.2]oct-2-yl)-(6-methoxy-quinolin-4-yl)-methyl ester")
