SpectraBase Spectrum ID |
IcXOr5Ab86P |
Name |
N-[3-[3-[5-[[1-(tert-Butoxycarbonyl)-2(S)-azetidinyl]methoxy]-3-pyridyl]phenyl]propyl]acetamide |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C25H33N3O4 |
InChI |
InChI=1S/C25H33N3O4/c1-18(29)27-11-6-8-19-7-5-9-20(13-19)21-14-23(16-26-15-21)31-17-22-10-12-28(22)24(30)32-25(2,3)4/h5,7,9,13-16,22H,6,8,10-12,17H2,1-4H3,(H,27,29)/t22-/m0/s1 |
InChIKey |
BJUFZKUYZTUQNV-QFIPXVFZSA-N |
Ionization Type |
EI |
Molecular Weight |
439.556 g/mol |
Optical Rotation |
[a]D546 = -42.2 (c = 5.85 g/L, EtOAc) |
SMILES |
N(CCCc1cc(-c2cncc(OC[C@@]3(CCN3C(OC(C)(C)C)=O)[H])c2)ccc1)C(C)=O |
SPLASH |
splash10-0a4i-9221000000-6e03f51ce2e1175e33cd |
Source of Spectrum |
US20100152450A1 |
Wiley ID |
1842410 |