Vitas-M small molecule compound

dimethyl 4-(4-hydroxy-3-methoxy-5-nitrophenyl)-1-(2-phenylethyl)-1,4-dihydropyridine-3,5-dicarboxylate

Catalog ID
STK404297
SMILES COC(=O)C1=CN(CCc2ccccc2)C=C(C1c1cc(OC)c(c(c1)[N+](=O)[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 C24H24N2O8 MW 468.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24N2O8/c1-32-20-12-16(11-19(22(20)27)26(30)31)21-17(23(28)33-2)13-25(14-18(21)24(29)34-3)10-9-15-7-5-4-6-8-15/h4-8,11-14,21,27H,9-10H2,1-3H3
InChIKey
XSWBTGHDSVNGKJ-UHFFFAOYSA-N
Synonyms

COC(=O)C1=CN(CCc2ccccc2)C=C(C1c1cc(OC)c(c(c1)(N+)(=O)(O))O)C(=O)OC
COC1=CC(=CC(=C1O)(N+)(=O)(O))C2C(=CN(C=C2C(=O)OC)CCC3=CC=CC=C3)C(=O)OC
dimethyl4(4hydroxy3methoxy5nitrophenyl)1(2phenylethyl)14dihydropyridine35dicarboxylate
dimethyl4(4hydroxy3methoxy5nitrophenyl)1(2phenylethyl)4Hpyridine35dicarboxylate
DIMETHYL4(4HYDROXY3METHOXY5NITROPHENYL)1PHENETHYL4HPYRIDINE35DICARBOXYLATE
InChI=1SC24H24N2O8c132201216(1119(22(20)27)26(30)31)2117(23(28)332)1325(1418(21)24(29)343)109157546815h4811142127H910H213H3
METHYL4(4HYDROXY5METHOXY3NITROPHENYL)5(METHOXYCARBONYL)1(2PHENYLETHYL)14DIHYDROPYRIDINE3CARBOXYLATE
MFCD03717456
ZINC000016247275
ZINC16247275

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.