Vitas-M small molecule compound
dimethyl 4-(4-chloro-3-nitrophenyl)-1-(tetrahydrofuran-2-ylmethyl)-1,4-dihydropyridine-3,5-dicarboxylate
Catalog ID
STK003649
SMILES COC(=O)C1=CN(CC2CCCO2)C=C(C1c1ccc(c(c1)[N+](=O)[O-])Cl)C(=O)OC
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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 C20H21ClN2O7 MW 436.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21ClN2O7/c1-28-19(24)14-10-22(9-13-4-3-7-30-13)11-15(20(25)29-2)18(14)12-5-6-16(21)17(8-12)23(26)27/h5-6,8,10-11,13,18H,3-4,7,9H2,1-2H3InChIKey
ZYOCOCMGYIDYGB-UHFFFAOYSA-NSynonyms
COC(=O)C1=CN(C=C(C1C2=CC(=C(C=C2)Cl)(N+)(=O)(O))C(=O)OC)CC3CCCO3
COC(=O)C1=CN(CC2CCCO2)C=C(C1c1ccc(c(c1)(N+)(=O)(O))Cl)C(=O)OC
DIMETHYL4(4CHLORO3NITROPHENYL)1(OXOLAN2YLMETHYL)4HPYRIDINE35DICARBOXYLATE
DIMETHYL4(4CHLORO3NITROPHENYL)1(TETRAHYDROFURAN2YLMETHYL)14DIHYDROPYRIDINE35DICARBOXYLATE
InChI=1SC20H21ClN2O7c12819(24)141022(9134373013)1115(20(25)292)18(14)125616(21)17(812)23(26)27h56810111318H3479H212H3
METHYL4(4CHLORO3NITROPHENYL)5(METHOXYCARBONYL)1(OXOLAN2YLMETHYL)14DIHYDROPYRIDINE3CARBOXYLATE
MFCD02766751
STK003649
ZINC000001184404
ZINC000001184405
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