Vitas-M small molecule compound

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

Catalog ID
STK405649
SMILES CCCCN1C=C(C(=O)OC)C(C(=C1)C(=O)OC)c1ccc(cc1)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 C19H23NO5 MW 345.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23NO5/c1-4-5-10-20-11-15(18(22)24-2)17(16(12-20)19(23)25-3)13-6-8-14(21)9-7-13/h6-9,11-12,17,21H,4-5,10H2,1-3H3
InChIKey
XHWSSEBQIOJNGJ-UHFFFAOYSA-N
Synonyms

CCCCN1C=C(C(C(=C1)C(=O)OC)C2=CC=C(C=C2)O)C(=O)OC
dimethyl1butyl4(4hydroxyphenyl)14dihydropyridine35dicarboxylate
DIMETHYL1BUTYL4(4HYDROXYPHENYL)4HPYRIDINE35DICARBOXYLATE
InChI=1SC19H23NO5c14510201115(18(22)242)17(16(1220)19(23)253)136814(21)9713h6911121721H4510H213H3
METHYL1BUTYL4(4HYDROXYPHENYL)5(METHOXYCARBONYL)14DIHYDROPYRIDINE3CARBOXYLATE
MFCD04211009
ZINC000002838894
ZINC02838894
ZINC2838894

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Available files

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