Catalog Number:
AG01B2RG
Chemical Name:
1-{1-[(tert-butoxy)carbonyl]azepan-4-yl}-1H-1,2,3-triazole-4-carboxylic acid
CAS Number:
1955554-96-7
Molecular Formula:
C14H22N4O4
Molecular Weight:
310.3489
MDL Number:
MFCD29991712
IUPAC Name:
1-[1-[(2-methylpropan-2-yl)oxycarbonyl]azepan-4-yl]triazole-4-carboxylic acid
InChI:
InChI=1S/C14H22N4O4/c1-14(2,3)22-13(21)17-7-4-5-10(6-8-17)18-9-11(12(19)20)15-16-18/h9-10H,4-8H2,1-3H3,(H,19,20)
InChI Key:
ZEGMJZKGUPCLQP-UHFFFAOYSA-N
SMILES:
O=C(N1CCCC(CC1)n1nnc(c1)C(=O)O)OC(C)(C)C