SpectraBase Spectrum ID |
B28EyMJJjtY |
Name |
(4S)-5-Acetyl-7-methyl-4-(4-nitrophenyl)-4,5-dihydro-1H-[1,5]benzodiazepin-2(3H)-one |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C18H17N3O4 |
InChI |
InChI=1S/C18H17N3O4/c1-11-3-8-15-17(9-11)20(12(2)22)16(10-18(23)19-15)13-4-6-14(7-5-13)21(24)25/h3-9,16H,10H2,1-2H3,(H,19,23)/t16-/m0/s1 |
InChIKey |
WDGFXBDDOSCIRU-INIZCTEOSA-N |
Literature Reference DOI |
10.1002/adsc.201000547 |
Molecular Weight |
339.351 g/mol |
SMILES |
N1c2ccc(cc2N([C@@](CC1=O)(c1ccc(cc1)[N+](=O)[O-])[H])C(=O)C)C |
SPLASH |
splash10-0012-0986000000-b1bfd56d5b2672df983b |
Source of Spectrum |
ASC-352-2629/SM4-5e |
Synonyms |
(S)-5-acetyl-7-methyl-4-(4-nitrophenyl)-4,5-dihydro-1H-benzo[b][1,4]diazepin-2(3H)-one |
Wiley ID |
1764013 |