Vitas-M small molecule compound
dimethyl 1-(1,3-benzodioxol-5-ylmethyl)-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Catalog ID
STK405662
SMILES COC(=O)C1=CN(Cc2ccc3c(c2)OCO3)C=C(C1c1cccc(c1)[N+](=O)[O-])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 C23H20N2O8 MW 452.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N2O8/c1-30-22(26)17-11-24(10-14-6-7-19-20(8-14)33-13-32-19)12-18(23(27)31-2)21(17)15-4-3-5-16(9-15)25(28)29/h3-9,11-12,21H,10,13H2,1-2H3InChIKey
DQFISKDLXUPZRI-UHFFFAOYSA-NSynonyms
COC(=O)C1=CN(C=C(C1C2=CC(=CC=C2)(N+)(=O)(O))C(=O)OC)CC3=CC4=C(C=C3)OCO4
COC(=O)C1=CN(Cc2ccc3c(c2)OCO3)C=C(C1c1cccc(c1)(N+)(=O)(O))C(=O)OC
dimethyl1(13benzodioxol5ylmethyl)4(3nitrophenyl)14dihydropyridine35dicarboxylate
DIMETHYL1(13BENZODIOXOL5YLMETHYL)4(3NITROPHENYL)4HPYRIDINE35DICARBOXYLATE
InChI=1SC23H20N2O8c13022(26)171124(1014671920(814)33133219)1218(23(27)312)21(17)1543516(915)25(28)29h39111221H1013H212H3
METHYL1(2HBENZO(34D)13DIOXOLAN5YLMETHYL)5(METHOXYCARBONYL)4(3NITROPHENYL)14DIHYDROPYRIDINE3CARBOXYLATE
MFCD04216070
ZINC000002844586
ZINC02844586
ZINC2844586
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