Vitas-M small molecule compound

dimethyl 1-benzyl-4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Catalog ID
STK404179
SMILES CCOc1cc(cc(c1O)[N+](=O)[O-])C1C(=CN(C=C1C(=O)OC)Cc1ccccc1)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/c1-4-34-20-11-16(10-19(22(20)27)26(30)31)21-17(23(28)32-2)13-25(14-18(21)24(29)33-3)12-15-8-6-5-7-9-15/h5-11,13-14,21,27H,4,12H2,1-3H3
InChIKey
COVIKZDDZQNWQH-UHFFFAOYSA-N
Synonyms

CCOC1=CC(=CC(=C1O)(N+)(=O)(O))C2C(=CN(C=C2C(=O)OC)CC3=CC=CC=C3)C(=O)OC
CCOc1cc(cc(c1O)(N+)(=O)(O))C1C(=CN(C=C1C(=O)OC)Cc1ccccc1)C(=O)OC
dimethyl1benzyl4(3ethoxy4hydroxy5nitrophenyl)14dihydropyridine35dicarboxylate
DIMETHYL1BENZYL4(3ETHOXY4HYDROXY5NITROPHENYL)4HPYRIDINE35DICARBOXYLATE
InChI=1SC24H24N2O8c1434201116(1019(22(20)27)26(30)31)2117(23(28)322)1325(1418(21)24(29)333)12158657915h51113142127H412H213H3
METHYL4(5ETHOXY4HYDROXY3NITROPHENYL)5(METHOXYCARBONYL)1BENZYL14DIHYDROPYRIDINE3CARBOXYLATE
MFCD03717478
ZINC000035877084
ZINC35877084

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Available files

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