SpectraBase Spectrum ID |
JnqU4d6U2B0 |
Name |
1-[4-(2H-1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-(4-nitro-1H-pyrazol-1-yl)propan-1-one |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C18H21N5O5 |
InChI |
InChI=1S/C18H21N5O5/c1-13(22-11-15(9-19-22)23(25)26)18(24)21-6-4-20(5-7-21)10-14-2-3-16-17(8-14)28-12-27-16/h2-3,8-9,11,13H,4-7,10,12H2,1H3 |
InChIKey |
DTIHCFXULUEVIL-UHFFFAOYSA-N |
Molecular Weight |
387.396 g/mol |
SMILES |
c1(N(=O)=O)c[n](C(C(=O)N2CCN(CC2)Cc2cc3OCOc3cc2)C)nc1 |
SPLASH |
splash10-000i-5901000000-f369e1a2b541608704dd |
Source of Spectrum |
IY-2-5013-6 |
Synonyms |
Piperazine, 1-(1,3-benzodioxol-5-ylmethyl)-4-[2-(4-nitro-1H-pyrazol-1-yl)-1-oxopropyl]-
1-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-2-(4-nitro-1-pyrazolyl)-1-propanone
1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-(4-nitropyrazol-1-yl)propan-1-one |
Wiley ID |
1658119 |