Catalog Number:
AG01BDZU
Chemical Name:
sodium 1-{1-[(tert-butoxy)carbonyl]piperidin-3-yl}-1H-1,2,4-triazole-3-carboxylate
CAS Number:
1803590-63-7
Molecular Formula:
C13H19N4NaO4
Molecular Weight:
318.3041
MDL Number:
MFCD28063750
IUPAC Name:
sodium;1-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-3-yl]-1,2,4-triazole-3-carboxylate
InChI:
InChI=1S/C13H20N4O4.Na/c1-13(2,3)21-12(20)16-6-4-5-9(7-16)17-8-14-10(15-17)11(18)19;/h8-9H,4-7H2,1-3H3,(H,18,19);/q;+1/p-1
InChI Key:
LGNLLZAKEWPLOV-UHFFFAOYSA-M
SMILES:
O=C(N1CCCC(C1)n1cnc(n1)C(=O)[O-])OC(C)(C)C.[Na+]
