Vitas-M small molecule compound

dimethyl 4-(3-hydroxyphenyl)-1-methyl-1,4-dihydropyridine-3,5-dicarboxylate

Catalog ID
STK403565
SMILES COC(=O)C1=CN(C)C=C(C1c1cccc(c1)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 C16H17NO5 MW 303.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17NO5/c1-17-8-12(15(19)21-2)14(13(9-17)16(20)22-3)10-5-4-6-11(18)7-10/h4-9,14,18H,1-3H3
InChIKey
LWGUCZQUJDPBDO-UHFFFAOYSA-N
Synonyms

CN1C=C(C(C(=C1)C(=O)OC)C2=CC(=CC=C2)O)C(=O)OC
dimethyl4(3hydroxyphenyl)1methyl14dihydropyridine35dicarboxylate
DIMETHYL4(3HYDROXYPHENYL)1METHYL4HPYRIDINE35DICARBOXYLATE
InChI=1SC16H17NO5c117812(15(19)212)14(13(917)16(20)223)1054611(18)710h491418H13H3
METHYL4(3HYDROXYPHENYL)5(METHOXYCARBONYL)1METHYL14DIHYDROPYRIDINE3CARBOXYLATE
MFCD03489430
ZINC000000223142
ZINC00223142
ZINC223142

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Available files

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