Vitas-M small molecule compound
dimethyl 4-(3-nitrophenyl)-1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1,4-dihydropyridine-3,5-dicarboxylate
Catalog ID
STK701223
SMILES COC(=O)C1=CN(C=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)OC)C12CC3CC(C2)CC(C1)C3
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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 C25H28N2O6 MW 452.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N2O6/c1-32-23(28)20-13-26(25-10-15-6-16(11-25)8-17(7-15)12-25)14-21(24(29)33-2)22(20)18-4-3-5-19(9-18)27(30)31/h3-5,9,13-17,22H,6-8,10-12H2,1-2H3InChIKey
FBDSVFHJEUIZES-UHFFFAOYSA-NSynonyms
COC(=O)C1=CN(C=C(C1c1cccc(c1)(N+)(=O)(O))C(=O)OC)C12CC3CC(C2)CC(C1)C3
COC(=O)C1=CN(C=C(C1C2=CC(=CC=C2)(N+)(=O)(O))C(=O)OC)C34CC5CC(C3)CC(C5)C4
DIMETHYL1(1ADAMANTYL)4(3NITROPHENYL)4HPYRIDINE35DICARBOXYLATE
dimethyl4(3nitrophenyl)1(tricyclo(3311~37~)dec1yl)14dihydropyridine35dicarboxylate
InChI=1SC25H28N2O6c13223(28)201326(251015616(1125)817(715)1225)1421(24(29)332)22(20)1843519(918)27(30)31h359131722H681012H212H3
METHYL1ADAMANTANYL5(METHOXYCARBONYL)4(3NITROPHENYL)14DIHYDROPYRIDINE3CARBOXYLATE
MFCD02868465
ZINC000008955586
ZINC08955586
ZINC8955586
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