Vitas-M small molecule compound
dimethyl 1-(3-chloro-4-fluorophenyl)-4-(4-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Catalog ID
STK406041
SMILES COC(=O)C1=CN(C=C(C1c1ccc(cc1)[N+](=O)[O-])C(=O)OC)c1ccc(c(c1)Cl)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 C21H16ClFN2O6 MW 446.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16ClFN2O6/c1-30-20(26)15-10-24(14-7-8-18(23)17(22)9-14)11-16(21(27)31-2)19(15)12-3-5-13(6-4-12)25(28)29/h3-11,19H,1-2H3InChIKey
SCLYAZHVBUMOTJ-UHFFFAOYSA-NSynonyms
COC(=O)C1=CN(C=C(C1c1ccc(cc1)(N+)(=O)(O))C(=O)OC)c1ccc(c(c1)Cl)F
COC(=O)C1=CN(C=C(C1C2=CC=C(C=C2)(N+)(=O)(O))C(=O)OC)C3=CC(=C(C=C3)F)Cl
dimethyl1(3chloro4fluorophenyl)4(4nitrophenyl)14dihydropyridine35dicarboxylate
DIMETHYL1(3CHLORO4FLUOROPHENYL)4(4NITROPHENYL)4HPYRIDINE35DICARBOXYLATE
InChI=1SC21H16ClFN2O6c13020(26)151024(147818(23)17(22)914)1116(21(27)312)19(15)123513(6412)25(28)29h31119H12H3
METHYL1(3CHLORO4FLUOROPHENYL)5(METHOXYCARBONYL)4(4NITROPHENYL)14DIHYDROPYRIDINE3CARBOXYLATE
MFCD04216656
ZINC000001132902
ZINC01132902
ZINC1132902
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