SpectraBase Spectrum ID |
6y5z3vSBepP |
Name |
Piperazinetrione, 6-[[2-(1,1-dimethylpropyl)-6-(3-methylbutyl)-1H-indol-3-yl]methyl]- |
Alternate Name(s) |
6-[(6-isopentyl-2-tert-pentyl-1H-indol-3-yl)methyl]-2,3,5-piperazinetrione
Hexahydroneoechinulin
Hexahydroneoechinuline
Hydroneoechinuline |
CAS Registry Number |
65560-22-7 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C23H31N3O3 |
InChI |
InChI=1S/C23H31N3O3/c1-6-23(4,5)19-16(12-18-20(27)26-22(29)21(28)25-18)15-10-9-14(8-7-13(2)3)11-17(15)24-19/h9-11,13,18,24H,6-8,12H2,1-5H3,(H,25,28)(H,26,27,29) |
InChIKey |
YWIMZPQGJZKWRK-UHFFFAOYSA-N |
Molecular Weight |
397.519 g/mol |
SMILES |
[nH]1c2c(c(CC3C(NC(=O)C(N3)=O)=O)c1C(CC)(C)C)ccc(c2)CCC(C)C |
SPLASH |
splash10-00di-1490000000-b8e37169619b582e7542 |
Source of Spectrum |
BS-4-26-0 |
Wiley ID |
1368041 |