Vitas-M small molecule compound
3-nitro-4-{[3-(trifluoromethyl)phenyl]amino}-2H-chromen-2-one
Catalog ID
STL336499
SMILES [O-][N+](=O)c1c(=O)oc2c(c1Nc1cccc(c1)C(F)(F)F)cccc2
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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 C16H9F3N2O4 MW 350.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H9F3N2O4/c17-16(18,19)9-4-3-5-10(8-9)20-13-11-6-1-2-7-12(11)25-15(22)14(13)21(23)24/h1-8,20HInChIKey
IYHNUEKZAFADNW-UHFFFAOYSA-NSynonyms
738592-87-5(O)(N+)(=O)c1c(=O)oc2c(c1Nc1cccc(c1)C(F)(F)F)cccc2
3nitro4((3(trifluoromethyl)phenyl)amino)2Hchromen2one
3NITRO4(3(TRIFLUOROMETHYL)ANILINO)CHROMEN2ONE
738592875
C1=CC=C2C(=C1)C(=C(C(=O)O2)(N+)(=O)(O))NC3=CC=CC(=C3)C(F)(F)F
InChI=1SC16H9F3N2O4c1716(1819)943510(89)201311612712(11)2515(22)14(13)21(23)24h1820H
MFCD02286295
ZINC000004994568
ZINC04994568
ZINC4994568
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