SpectraBase Spectrum ID |
IKUWlokuJnU |
Name |
1-Acetyl-3-(2-bromo-5-isopropoxy-4-methoxy-3-methylphenylmethylene)-4-(4-methoxyphenylmethyl)-2,5-piperazinedione |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C26H29BrN2O6 |
InChI |
InChI=1S/C26H29BrN2O6/c1-15(2)35-22-12-19(24(27)16(3)25(22)34-6)11-21-26(32)28(17(4)30)14-23(31)29(21)13-18-7-9-20(33-5)10-8-18/h7-12,15H,13-14H2,1-6H3/b21-11+ |
InChIKey |
AYCCBRLRVSASOP-SRZZPIQSSA-N |
Molecular Weight |
545.430 g/mol |
SMILES |
C1(N(\C(C(N(C1)C(=O)C)=O)=C/c1c(c(C)c(c(c1)OC(C)C)OC)Br)Cc1ccc(cc1)OC)=O |
SPLASH |
splash10-00xr-0600900000-0198d27d67f22d48a9e5 |
Source of Spectrum |
E2-48-1552-10 |
Synonyms |
(3E)-1-acetyl-3-(2-bromo-5-isopropoxy-4-methoxy-3-methylbenzylidene)-4-(4-methoxybenzyl)-2,5-piperazinedione |
Wiley ID |
1555335 |