Vitas-M small molecule compound

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

Catalog ID
STK402992
SMILES COCCN1C=C(C(=O)OC)C(C(=C1)C(=O)OC)c1cccc(c1)[N+](=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 C18H20N2O7 MW 376.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N2O7/c1-25-8-7-19-10-14(17(21)26-2)16(15(11-19)18(22)27-3)12-5-4-6-13(9-12)20(23)24/h4-6,9-11,16H,7-8H2,1-3H3
InChIKey
SCZWDFXVVMWOIH-UHFFFAOYSA-N
Synonyms

COCCN1C=C(C(=O)OC)C(C(=C1)C(=O)OC)c1cccc(c1)(N+)(=O)(O)
COCCN1C=C(C(C(=C1)C(=O)OC)C2=CC(=CC=C2)(N+)(=O)(O))C(=O)OC
dimethyl1(2methoxyethyl)4(3nitrophenyl)14dihydropyridine35dicarboxylate
DIMETHYL1(2METHOXYETHYL)4(3NITROPHENYL)4HPYRIDINE35DICARBOXYLATE
InChI=1SC18H20N2O7c12587191014(17(21)262)16(15(1119)18(22)273)1254613(912)20(23)24h4691116H78H213H3
MFCD03145200
ZINC000002731659
ZINC02731659
ZINC2731659

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Available files

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