Vitas-M small molecule compound

dimethyl 4-(3-bromo-4-ethoxy-5-methoxyphenyl)-1-methyl-1,4-dihydropyridine-3,5-dicarboxylate

Catalog ID
STK404153
SMILES CCOc1c(Br)cc(cc1OC)C1C(=CN(C=C1C(=O)OC)C)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 C19H22BrNO6 MW 440.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22BrNO6/c1-6-27-17-14(20)7-11(8-15(17)24-3)16-12(18(22)25-4)9-21(2)10-13(16)19(23)26-5/h7-10,16H,6H2,1-5H3
InChIKey
GHWXGIMICMXCPZ-UHFFFAOYSA-N
Synonyms

CCOC1=C(C=C(C=C1Br)C2C(=CN(C=C2C(=O)OC)C)C(=O)OC)OC
dimethyl4(3bromo4ethoxy5methoxyphenyl)1methyl14dihydropyridine35dicarboxylate
DIMETHYL4(3BROMO4ETHOXY5METHOXYPHENYL)1METHYL4HPYRIDINE35DICARBOXYLATE
InChI=1SC19H22BrNO6c16271714(20)711(815(17)243)1612(18(22)254)921(2)1013(16)19(23)265h71016H6H215H3
METHYL4(3BROMO4ETHOXY5METHOXYPHENYL)5(METHOXYCARBONYL)1METHYL14DIHYDROPYRIDINE3CARBOXYLATE
MFCD04056969
ZINC000001459560
ZINC01459560
ZINC1459560

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Available files

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