Vitas-M small molecule compound
2-[(2-methylacryloyl)oxy]ethyl 6-amino-5-cyano-2-methyl-4-(4-nitrophenyl)-4H-pyran-3-carboxylate
Catalog ID
STK072758
SMILES N#CC1=C(N)OC(=C(C1c1ccc(cc1)[N+](=O)[O-])C(=O)OCCOC(=O)C(=C)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 C20H19N3O7 MW 413.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N3O7/c1-11(2)19(24)28-8-9-29-20(25)16-12(3)30-18(22)15(10-21)17(16)13-4-6-14(7-5-13)23(26)27/h4-7,17H,1,8-9,22H2,2-3H3InChIKey
SPJMOZVMXLENET-UHFFFAOYSA-NSynonyms
2((2METHYLACRYLOYL)OXY)ETHYL6AMINO5CYANO2METHYL4(4NITROPHENYL)4HPYRAN3CARBOXYLATE
2(2METHYLPROP2ENOYLOXY)ETHYL6AMINO5CYANO2METHYL4(4NITROPHENYL)4HPYRAN3CARBOXYLATE
2(6AMINO5CYANO2METHYL4(4NITROPHENYL)4HPYRAN3YLCARBONYLOXY)ETHYL2METHYLPROP2ENOATE
CC1=C(C(C(=C(O1)N)C#N)C2=CC=C(C=C2)(N+)(=O)(O))C(=O)OCCOC(=O)C(=C)C
InChI=1SC20H19N3O7c111(2)19(24)28892920(25)1612(3)3018(22)15(1021)17(16)134614(7513)23(26)27h4717H18922H223H3
MFCD02604241
N#CC1=C(N)OC(=C(C1c1ccc(cc1)(N+)(=O)(O))C(=O)OCCOC(=O)C(=C)C)C
STK072758
ZINC000004599867
ZINC000004599868
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