Vitas-M small molecule compound
2-[(2-methylacryloyl)oxy]ethyl 6-amino-4-(2-chloro-5-nitrophenyl)-5-cyano-2-methyl-4H-pyran-3-carboxylate
Catalog ID
STK526462
SMILES [O-][N+](=O)c1cc(C2C(=C(C)OC(=C2C#N)N)C(=O)OCCOC(=O)C(=C)C)c(cc1)Cl
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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 C20H18ClN3O7 MW 447.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18ClN3O7/c1-10(2)19(25)29-6-7-30-20(26)16-11(3)31-18(23)14(9-22)17(16)13-8-12(24(27)28)4-5-15(13)21/h4-5,8,17H,1,6-7,23H2,2-3H3InChIKey
INLAMLURSPPBGQ-UHFFFAOYSA-NSynonyms
372090-31-8(O)(N+)(=O)c1cc(C2C(=C(C)OC(=C2C#N)N)C(=O)OCCOC(=O)C(=C)C)c(cc1)Cl
2((2methylacryloyl)oxy)ethyl6amino4(2chloro5nitrophenyl)5cyano2methyl4Hpyran3carboxylate
2(2METHYLPROP2ENOYLOXY)ETHYL6AMINO4(2CHLORO5NITROPHENYL)5CYANO2METHYL4HPYRAN3CARBOXYLATE
2(methacryloyloxy)ethyl6amino4(2chloro5nitrophenyl)5cyano2methyl4Hpyran3carboxylate
372090318
CC1=C(C(C(=C(O1)N)C#N)C2=C(C=CC(=C2)(N+)(=O)(O))Cl)C(=O)OCCOC(=O)C(=C)C
InChI=1SC20H18ClN3O7c110(2)19(25)29673020(26)1611(3)3118(23)14(922)17(16)13812(24(27)28)4515(13)21h45817H16723H223H3
MFCD01877727
ZINC000001764074
ZINC000001764075
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