Vitas-M small molecule compound
2-(3,4-dimethoxyphenyl)-7,7-dimethyl-1-(3-nitrophenyl)-2,3,7,8-tetrahydroquinoline-4,5(1H,6H)-dione
Catalog ID
STK770073
SMILES COc1cc(ccc1OC)C1CC(=O)C2=C(N1c1cccc(c1)[N+](=O)[O-])CC(CC2=O)(C)C
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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 C25H26N2O6 MW 450.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N2O6/c1-25(2)13-19-24(21(29)14-25)20(28)12-18(15-8-9-22(32-3)23(10-15)33-4)26(19)16-6-5-7-17(11-16)27(30)31/h5-11,18H,12-14H2,1-4H3InChIKey
SJOFYBDBKAFSIJ-UHFFFAOYSA-NSynonyms
2(34dimethoxyphenyl)77dimethyl1(3nitrophenyl)2368tetrahydroquinoline45dione
2(34dimethoxyphenyl)77dimethyl1(3nitrophenyl)2378tetrahydroquinoline45(1H6H)dione
CC1(CC2=C(C(=O)CC(N2C3=CC(=CC=C3)(N+)(=O)(O))C4=CC(=C(C=C4)OC)OC)C(=O)C1)C
COc1cc(ccc1OC)C1CC(=O)C2=C(N1c1cccc(c1)(N+)(=O)(O))CC(CC2=O)(C)C
InChI=1SC25H26N2O6c125(2)131924(21(29)1425)20(28)1218(158922(323)23(1015)334)26(19)1665717(1116)27(30)31h51118H1214H214H3
MFCD03764036
ZINC000001072360
ZINC000001072362
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