Vitas-M small molecule compound
2-(5-methyl-2-nitro-1H-imidazol-1-yl)ethyl 3-(1,1,2,2-tetrafluoroethoxy)benzoate
Catalog ID
STK777331
SMILES FC(C(Oc1cccc(c1)C(=O)OCCn1c(C)cnc1[N+](=O)[O-])(F)F)F
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C15H13F4N3O5 MW 391.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13F4N3O5/c1-9-8-20-14(22(24)25)21(9)5-6-26-12(23)10-3-2-4-11(7-10)27-15(18,19)13(16)17/h2-4,7-8,13H,5-6H2,1H3InChIKey
IRXMMQQVMUFVPF-UHFFFAOYSA-NSynonyms
2(5methyl2nitro1Himidazol1yl)ethyl3(1122tetrafluoroethoxy)benzoate
2(5methyl2nitroimidazol1yl)ethyl3(1122tetrafluoroethoxy)benzoate
CC1=CN=C(N1CCOC(=O)C2=CC(=CC=C2)OC(C(F)F)(F)F)(N+)(=O)(O)
FC(C(Oc1cccc(c1)C(=O)OCCn1c(C)cnc1(N+)(=O)(O))(F)F)F
InChI=1SC15H13F4N3O5c1982014(22(24)25)21(9)562612(23)1032411(710)2715(1819)13(16)17h247813H56H21H3
MFCD05260343
ZINC000001425149
ZINC01425149
ZINC1425149
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