Vitas-M small molecule compound
3-(3,4-difluorophenyl)-2-methyl-8-nitro-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocin-4-one
Catalog ID
STL094866
SMILES O=C1NC2CC(N1c1ccc(c(c1)F)F)(C)Oc1c2cc(cc1)[N+](=O)[O-]
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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 C17H13F2N3O4 MW 361.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13F2N3O4/c1-17-8-14(11-6-10(22(24)25)3-5-15(11)26-17)20-16(23)21(17)9-2-4-12(18)13(19)7-9/h2-7,14H,8H2,1H3,(H,20,23)InChIKey
FNSWXQUSODANSV-UHFFFAOYSA-NSynonyms
899986-60-83(34difluorophenyl)2methyl8nitro2356tetrahydro4H26methano135benzoxadiazocin4one
3(34DIFLUOROPHENYL)2METHYL8NITRO56DIHYDRO2H26METHANOBENZO(G)(135)OXADIAZOCIN4(3H)ONE
899986608
CC12CC(C3=C(O1)C=CC(=C3)(N+)(=O)(O))NC(=O)N2C4=CC(=C(C=C4)F)F
InChI=1SC17H13F2N3O4c117814(11610(22(24)25)3515(11)2617)2016(23)21(17)92412(18)13(19)79h2714H8H21H3(H2023)
MFCD07650961
O=C1NC2CC(N1c1ccc(c(c1)F)F)(C)Oc1c2cc(cc1)(N+)(=O)(O)
ZINC000004852816
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