Vitas-M small molecule compound
dimethyl 1-(4-chlorobenzyl)-4-(4-methyl-3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Catalog ID
STK404744
SMILES COC(=O)C1=CN(Cc2ccc(cc2)Cl)C=C(C1c1ccc(c(c1)[N+](=O)[O-])C)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 C23H21ClN2O6 MW 456.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21ClN2O6/c1-14-4-7-16(10-20(14)26(29)30)21-18(22(27)31-2)12-25(13-19(21)23(28)32-3)11-15-5-8-17(24)9-6-15/h4-10,12-13,21H,11H2,1-3H3InChIKey
RXWJETURUNDTOH-UHFFFAOYSA-NSynonyms
CC1=C(C=C(C=C1)C2C(=CN(C=C2C(=O)OC)CC3=CC=C(C=C3)Cl)C(=O)OC)(N+)(=O)(O)
COC(=O)C1=CN(Cc2ccc(cc2)Cl)C=C(C1c1ccc(c(c1)(N+)(=O)(O))C)C(=O)OC
DIMETHYL1((4CHLOROPHENYL)METHYL)4(4METHYL3NITROPHENYL)4HPYRIDINE35DICARBOXYLATE
dimethyl1(4chlorobenzyl)4(4methyl3nitrophenyl)14dihydropyridine35dicarboxylate
InChI=1SC23H21ClN2O6c1144716(1020(14)26(29)30)2118(22(27)312)1225(1319(21)23(28)323)11155817(24)9615h410121321H11H213H3
METHYL1((4CHLOROPHENYL)METHYL)5(METHOXYCARBONYL)4(4METHYL3NITROPHENYL)14DIHYDROPYRIDINE3CARBOXYLATE
MFCD05993000
ZINC000002861169
ZINC02861169
ZINC2861169
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