Vitas-M small molecule compound

dimethyl 4-(4-nitrophenyl)-1-(propan-2-yl)-1,4-dihydropyridine-3,5-dicarboxylate

Catalog ID
STK403563
SMILES COC(=O)C1=CN(C=C(C1c1ccc(cc1)[N+](=O)[O-])C(=O)OC)C(C)C

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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 C18H20N2O6 MW 360.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N2O6/c1-11(2)19-9-14(17(21)25-3)16(15(10-19)18(22)26-4)12-5-7-13(8-6-12)20(23)24/h5-11,16H,1-4H3
InChIKey
MFTGCBMUTMFHIA-UHFFFAOYSA-N
Synonyms

CC(C)N1C=C(C(C(=C1)C(=O)OC)C2=CC=C(C=C2)(N+)(=O)(O))C(=O)OC
COC(=O)C1=CN(C=C(C1c1ccc(cc1)(N+)(=O)(O))C(=O)OC)C(C)C
dimethyl4(4nitrophenyl)1(propan2yl)14dihydropyridine35dicarboxylate
DIMETHYL4(4NITROPHENYL)1PROPAN2YL4HPYRIDINE35DICARBOXYLATE
InChI=1SC18H20N2O6c111(2)19914(17(21)253)16(15(1019)18(22)264)125713(8612)20(23)24h51116H14H3
MFCD03489428
ZINC000002797120
ZINC02797120
ZINC2797120

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Available files

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