SpectraBase Spectrum ID |
7Q9KnKwnHc4 |
Name |
1H-Isoindol-1-one, 2,3,3a,4,5,6-hexahydro-5-hydroxy-2-phenyl-6-(1-pyrrolidinyl)-, (3a.alpha.,5.beta.,6.alpha.)- |
CAS Registry Number |
114431-38-8 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C18H22N2O2 |
InChI |
InChI=1S/C18H22N2O2/c21-17-10-13-12-20(14-6-2-1-3-7-14)18(22)15(13)11-16(17)19-8-4-5-9-19/h1-3,6-7,11,13,16-17,21H,4-5,8-10,12H2/t13-,16-,17-/m1/s1 |
InChIKey |
PIVBMVQVVVLDPY-KBRIMQKVSA-N |
Molecular Weight |
298.386 g/mol |
SMILES |
O[C@@]1(C[C@]2(C(C(N(C2)c2ccccc2)=O)=C[C@]1(N1CCCC1)[H])[H])[H] |
SPLASH |
splash10-0udi-1090000000-89c5e103aba681eee076 |
Source of Spectrum |
AJ-60-3265-6 |
Synonyms |
(3aS,5R,6R)-5-hydroxy-2-phenyl-6-(1-pyrrolidinyl)-2,3,3a,4,5,6-hexahydro-1H-isoindol-1-one
3a,4,5,6-tetrahydro-2-phenyl-5-hydroxy-6-(tetrahydropyrrol-1-yl)-1-isoindolinone |
Wiley ID |
1301178 |