Catalog Number:
AG00IEMZ
Chemical Name:
3-(4-(tert-Butoxycarbonyl)piperazin-1-ylsulfonyl)benzoic acid
CAS Number:
874838-79-6
Molecular Formula:
C16H22N2O6S
Molecular Weight:
370.4207
MDL Number:
MFCD07774154
IUPAC Name:
3-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]sulfonylbenzoic acid
InChI:
InChI=1S/C16H22N2O6S/c1-16(2,3)24-15(21)17-7-9-18(10-8-17)25(22,23)13-6-4-5-12(11-13)14(19)20/h4-6,11H,7-10H2,1-3H3,(H,19,20)
InChI Key:
NEONUMCAWBLQLU-UHFFFAOYSA-N
SMILES:
O=C(N1CCN(CC1)S(=O)(=O)c1cccc(c1)C(=O)O)OC(C)(C)C
