Vitas-M small molecule compound
dimethyl 4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-1-(2-methoxyethyl)-1,4-dihydropyridine-3,5-dicarboxylate
Catalog ID
STK404291
SMILES COCCN1C=C(C(=O)OC)C(C(=C1)C(=O)OC)c1cc(OCC)c(c(c1)[N+](=O)[O-])O
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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 C20H24N2O9 MW 436.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N2O9/c1-5-31-16-9-12(8-15(18(16)23)22(26)27)17-13(19(24)29-3)10-21(6-7-28-2)11-14(17)20(25)30-4/h8-11,17,23H,5-7H2,1-4H3InChIKey
DKPRLKAZQCEAHK-UHFFFAOYSA-NSynonyms
CCOC1=CC(=CC(=C1O)(N+)(=O)(O))C2C(=CN(C=C2C(=O)OC)CCOC)C(=O)OC
COCCN1C=C(C(=O)OC)C(C(=C1)C(=O)OC)c1cc(OCC)c(c(c1)(N+)(=O)(O))O
dimethyl4(3ethoxy4hydroxy5nitrophenyl)1(2methoxyethyl)14dihydropyridine35dicarboxylate
DIMETHYL4(3ETHOXY4HYDROXY5NITROPHENYL)1(2METHOXYETHYL)4HPYRIDINE35DICARBOXYLATE
InChI=1SC20H24N2O9c153116912(815(18(16)23)22(26)27)1713(19(24)293)1021(67282)1114(17)20(25)304h8111723H57H214H3
METHYL4(5ETHOXY4HYDROXY3NITROPHENYL)5(METHOXYCARBONYL)1(2METHOXYETHYL)14DIHYDROPYRIDINE3CARBOXYLATE
MFCD03717156
ZINC000035877220
ZINC35877220
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