Vitas-M small molecule compound

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

Catalog ID
STK403984
SMILES CCOC(=O)C1=CN(Cc2ccc(cc2)OC)C=C(C1c1ccc(cc1)[N+](=O)[O-])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 C25H26N2O7 MW 466.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N2O7/c1-4-33-24(28)21-15-26(14-17-6-12-20(32-3)13-7-17)16-22(25(29)34-5-2)23(21)18-8-10-19(11-9-18)27(30)31/h6-13,15-16,23H,4-5,14H2,1-3H3
InChIKey
YUSNQAZMMKQOQU-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=CN(C=C(C1C2=CC=C(C=C2)(N+)(=O)(O))C(=O)OCC)CC3=CC=C(C=C3)OC
CCOC(=O)C1=CN(Cc2ccc(cc2)OC)C=C(C1c1ccc(cc1)(N+)(=O)(O))C(=O)OCC
DIETHYL1((4METHOXYPHENYL)METHYL)4(4NITROPHENYL)4HPYRIDINE35DICARBOXYLATE
diethyl1(4methoxybenzyl)4(4nitrophenyl)14dihydropyridine35dicarboxylate
ETHYL5(ETHOXYCARBONYL)1((4METHOXYPHENYL)METHYL)4(4NITROPHENYL)14DIHYDROPYRIDINE3CARBOXYLATE
InChI=1SC25H26N2O7c143324(28)211526(141761220(323)13717)1622(25(29)3452)23(21)1881019(11918)27(30)31h613151623H4514H213H3
MFCD03632757
ZINC000002796951
ZINC02796951
ZINC2796951

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Available files

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