Vitas-M small molecule compound

diethyl 1-(4-methoxybenzyl)-4-(4-methyl-3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Catalog ID
STK404745
SMILES CCOC(=O)C1=CN(Cc2ccc(cc2)OC)C=C(C1c1ccc(c(c1)[N+](=O)[O-])C)C(=O)OCC

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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 C26H28N2O7 MW 480.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N2O7/c1-5-34-25(29)21-15-27(14-18-8-11-20(33-4)12-9-18)16-22(26(30)35-6-2)24(21)19-10-7-17(3)23(13-19)28(31)32/h7-13,15-16,24H,5-6,14H2,1-4H3
InChIKey
OAYNXVUGHQHDMY-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=CN(C=C(C1C2=CC(=C(C=C2)C)(N+)(=O)(O))C(=O)OCC)CC3=CC=C(C=C3)OC
CCOC(=O)C1=CN(Cc2ccc(cc2)OC)C=C(C1c1ccc(c(c1)(N+)(=O)(O))C)C(=O)OCC
DIETHYL1((4METHOXYPHENYL)METHYL)4(4METHYL3NITROPHENYL)4HPYRIDINE35DICARBOXYLATE
diethyl1(4methoxybenzyl)4(4methyl3nitrophenyl)14dihydropyridine35dicarboxylate
ETHYL5(ETHOXYCARBONYL)1((4METHOXYPHENYL)METHYL)4(4METHYL3NITROPHENYL)14DIHYDROPYRIDINE3CARBOXYLATE
InChI=1SC26H28N2O7c153425(29)211527(141881120(334)12918)1622(26(30)3562)24(21)1910717(3)23(1319)28(31)32h713151624H5614H214H3
MFCD05992424
ZINC000002921164
ZINC02921164
ZINC2921164

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Available files

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