| SpectraBase Spectrum ID |
4LHdevXl78S |
| Name |
Acetic acid (1R,5S,9S)-5-bromo-9-hydroxy-9-[(Z)-2-(2-isopropoxy-3-methoxy-phenyl)-vinyl]-3-methyl-3-aza-bicyclo[3.3.1]non-1-ylmethyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H34BrNO5 |
| InChI |
InChI=1S/C24H34BrNO5/c1-17(2)31-21-19(8-6-9-20(21)29-5)10-13-24(28)22(16-30-18(3)27)11-7-12-23(24,25)15-26(4)14-22/h6,8-10,13,17,28H,7,11-12,14-16H2,1-5H3/b13-10-/t22-,23-,24-/m0/s1 |
| InChIKey |
BEXHNWLIPGGFBK-OQFSEEEESA-N |
| Molecular Weight |
496.442 g/mol |
| SMILES |
O[C@]1([C@@]2(CN(C[C@@]1(Br)CCC2)C)COC(=O)C)\C=C/c1c(OC(C)C)c(OC)ccc1 |
| SPLASH |
splash10-0fml-0913100000-005e0755559d87e769b0 |
| Source of Spectrum |
KC-61-3766-23 |
| Synonyms |
1-Acetoxymethyl-5-bromo-3-methyl-9-exo-hydroxy-9-[2-(3-methoxy-2-isopropoxy)phenyl-Z-ethenyl]-3-azabicyclo[3.3.1]nonanecarboxylate
{(1R,5S,9S)-5-bromo-9-hydroxy-9-[(Z)-2-(2-isopropoxy-3-methoxyphenyl)ethenyl]-3-methyl-3-azabicyclo[3.3.1]non-1-yl}methyl acetate |
| Wiley ID |
1628584 |
![Acetic acid (1R,5S,9S)-5-bromo-9-hydroxy-9-[(Z)-2-(2-isopropoxy-3-methoxy-phenyl)-vinyl]-3-methyl-3-aza-bicyclo[3.3.1]non-1-ylmethyl ester](/api/spectrum/4LHdevXl78S/structure.png?h=300&w=458 "Acetic acid (1R,5S,9S)-5-bromo-9-hydroxy-9-[(Z)-2-(2-isopropoxy-3-methoxy-phenyl)-vinyl]-3-methyl-3-aza-bicyclo[3.3.1]non-1-ylmethyl ester")
