Vitas-M small molecule compound
diethyl [(1E)-2-amino-N-{[(3-nitrophenyl)carbonyl]oxy}-2-oxoethanimidoyl]phosphonate
Catalog ID
STK525058
SMILES CCOP(=O)(/C(=N/OC(=O)c1cccc(c1)[N+](=O)[O-])/C(=O)N)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 C13H16N3O8P MW 373.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16N3O8P/c1-3-22-25(21,23-4-2)12(11(14)17)15-24-13(18)9-6-5-7-10(8-9)16(19)20/h5-8H,3-4H2,1-2H3,(H2,14,17)/b15-12+InChIKey
BHOKZWKKQYRHFG-NTCAYCPXSA-NSynonyms
((E)(2AMINO1DIETHOXYPHOSPHORYL2OXOETHYLIDENE)AMINO)3NITROBENZOATE
(E)diethyl(2amino1(((3nitrobenzoyl)oxy)imino)2oxoethyl)phosphonate
CCOP(=O)(C(=NOC(=O)C1=CC(=CC=C1)(N+)(=O)(O))C(=O)N)OCC
CCOP(=O)(C(=NOC(=O)c1cccc(c1)(N+)(=O)(O))C(=O)N)OCC
diethyl((1E)2aminoN(((3nitrophenyl)carbonyl)oxy)2oxoethanimidoyl)phosphonate
InChI=1SC13H16N3O8Pc132225(212342)12(11(14)17)152413(18)965710(89)16(19)20h58H34H212H3(H21417)b1512+
MFCD01856854
ZINC000263632287
ZINC15986191
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