Catalog Number:
AG009C9R
Chemical Name:
Benzoic acid,5-fluoro-2-[2-(1-Methyl-1H-1,2,4-triazol-5-yl)acetyl]-3-nitro-,Methyl ester, (hydrochloride)(1
CAS Number:
1322616-35-2
Molecular Formula:
C13H12ClFN4O5
Molecular Weight:
358.7096
MDL Number:
MFCD25977287
IUPAC Name:
methyl 5-fluoro-2-[2-(2-methyl-1,2,4-triazol-3-yl)acetyl]-3-nitrobenzoate;hydrochloride
InChI:
InChI=1S/C13H11FN4O5.ClH/c1-17-11(15-6-16-17)5-10(19)12-8(13(20)23-2)3-7(14)4-9(12)18(21)22;/h3-4,6H,5H2,1-2H3;1H
InChI Key:
MKZYHPMXDLZFKB-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(F)cc(c1C(=O)Cc1ncnn1C)[N+](=O)[O-].Cl
