For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
4-(1,3-benzodioxol-5-ylmethyl)-N-(4-methylphenyl)sulfonyl-1-piperazinecarboxamide
SpectraBase Compound ID 4FtBZqOTRua
InChI InChI=1S/C20H23N3O5S/c1-15-2-5-17(6-3-15)29(25,26)21-20(24)23-10-8-22(9-11-23)13-16-4-7-18-19(12-16)28-14-27-18/h2-7,12H,8-11,13-14H2,1H3,(H,21,24)
InChIKey LKVKKUJBJKPLFV-UHFFFAOYSA-N
Mol Weight 417.48 g/mol
Molecular Formula C20H23N3O5S
Exact Mass 417.135842 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID EuY3HmDrr1a
Name 4-(1,3-benzodioxol-5-ylmethyl)-N-(4-methylphenyl)sulfonyl-1-piperazinecarboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H23N3O5S
InChI InChI=1S/C20H23N3O5S/c1-15-2-5-17(6-3-15)29(25,26)21-20(24)23-10-8-22(9-11-23)13-16-4-7-18-19(12-16)28-14-27-18/h2-7,12H,8-11,13-14H2,1H3,(H,21,24)
InChIKey LKVKKUJBJKPLFV-UHFFFAOYSA-N
Molecular Weight 417.480 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)C(N1CCN(CC1)Cc1cc2OCOc2cc1)=O
SPLASH splash10-000i-9600000000-0b2991051e58d562ae1c
Synonyms 4-(1,3-benzodioxol-5-ylmethyl)-N-(4-methylphenyl)sulfonyl-piperazine-1-carboxamide 4-(1,3-benzodioxol-5-ylmethyl)-N-(p-tolylsulfonyl)piperazine-1-carboxamide 4-Piperonyl-N-tosyl-piperazine-1-carboxamide
Wiley ID 1457771