SpectraBase Spectrum ID |
HPmdFeHzlHn |
Name |
Isoxazolo[5,4-e]indolizine-6-carbonitrile, 8-benzoyl-3a,5a,6,7,8,9a-hexahydro-3-(4-methoxyphenyl)-, (3a.alpha.,5a.beta.,6.alpha.,8.beta.,9a.alpha.)- |
CAS Registry Number |
110258-52-1 |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C24H21N3O3 |
InChI |
InChI=1S/C24H21N3O3/c1-29-18-9-7-15(8-10-18)22-19-11-12-20-17(14-25)13-21(27(20)24(19)30-26-22)23(28)16-5-3-2-4-6-16/h2-12,17,19-21,24H,13H2,1H3/t17-,19+,20+,21-,24-/m1/s1 |
InChIKey |
YCYYVWIGSDJDCO-HRSQTCHXSA-N |
Molecular Weight |
399.450 g/mol |
SMILES |
[C@]12(N3[C@@](C=C[C@]2(C(c2ccc(cc2)OC)=NO1)[H])([C@@](C#N)(C[C@@]3(C(=O)c1ccccc1)[H])[H])[H])[H] |
SPLASH |
splash10-0007-1390000000-20f2796f157a04f68daf |
Source of Spectrum |
AJ-59-3634-14 |
Synonyms |
(3aS,5aS,6S,8R,9aR)-8-benzoyl-3-(4-methoxyphenyl)-3a,5a,6,7,8,9a-hexahydroisoxazolo[5,4-e]indolizine-6-carbonitrile
1-Cyano-3-benzoyl-6-(p-methoxyphenyl)-1,2,3,3b,6b,8a-hexahydroindolizino[5,6-d]isoxazole |
Wiley ID |
1369062 |