Vitas-M small molecule compound
4-methyl-3-nitro-N-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl]benzamide
Catalog ID
STK451255
SMILES O=C(c1ccc(c(c1)[N+](=O)[O-])C)Nc1cc(OCC(F)(F)F)cc(c1)[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 C16H12F3N3O6 MW 399.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12F3N3O6/c1-9-2-3-10(4-14(9)22(26)27)15(23)20-11-5-12(21(24)25)7-13(6-11)28-8-16(17,18)19/h2-7H,8H2,1H3,(H,20,23)InChIKey
FEHPSJVOZNZIHA-UHFFFAOYSA-NSynonyms
(4METHYL3NITROPHENYL)N(3NITRO5(222TRIFLUOROETHOXY)PHENYL)CARBOXAMIDE
3NITRON(3NITRO5(222TRIFLUOROETHOXY)PHENYL)4METHYLBENZAMIDE
4methyl3nitroN(3nitro5(222trifluoroethoxy)phenyl)benzamide
CC1=C(C=C(C=C1)C(=O)NC2=CC(=CC(=C2)OCC(F)(F)F)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC16H12F3N3O6c192310(414(9)22(26)27)15(23)2011512(21(24)25)713(611)28816(1718)19h27H8H21H3(H2023)
MFCD03071814
O=C(c1ccc(c(c1)(N+)(=O)(O))C)Nc1cc(OCC(F)(F)F)cc(c1)(N+)(=O)(O)
ZINC000002101566
ZINC02101566
ZINC2101566
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