Vitas-M small molecule compound
(2E)-3-(2-chloro-6-fluorophenyl)-N-(4-methoxy-2-nitrophenyl)prop-2-enamide
Catalog ID
STK440818
SMILES COc1ccc(c(c1)[N+](=O)[O-])NC(=O)/C=C/c1c(F)cccc1Cl
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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 C16H12ClFN2O4 MW 350.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12ClFN2O4/c1-24-10-5-7-14(15(9-10)20(22)23)19-16(21)8-6-11-12(17)3-2-4-13(11)18/h2-9H,1H3,(H,19,21)/b8-6+InChIKey
JTKJDJQYKRYIEQ-SOFGYWHQSA-NSynonyms
(2E)3(2chloro6fluorophenyl)N(4methoxy2nitrophenyl)prop2enamide
(E)3(2CHLORO6FLUOROPHENYL)N(4METHOXY2NITROPHENYL)PROP2ENAMIDE
COC1=CC(=C(C=C1)NC(=O)C=CC2=C(C=CC=C2Cl)F)(N+)(=O)(O)
COc1ccc(c(c1)(N+)(=O)(O))NC(=O)C=Cc1c(F)cccc1Cl
InChI=1SC16H12ClFN2O4c124105714(15(910)20(22)23)1916(21)861112(17)32413(11)18h29H1H3(H1921)b86+
MFCD03364164
ZINC000004893644
ZINC04893644
ZINC4893644
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