Vitas-M small molecule compound
diethyl {5-[(1,3-benzodioxol-5-ylmethyl)amino]-2-(3-nitrophenyl)-1,3-oxazol-4-yl}phosphonate
Catalog ID
STK910290
SMILES CCOP(=O)(c1nc(oc1NCc1ccc2c(c1)OCO2)c1cccc(c1)[N+](=O)[O-])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 C21H22N3O8P MW 475.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N3O8P/c1-3-30-33(27,31-4-2)21-20(22-12-14-8-9-17-18(10-14)29-13-28-17)32-19(23-21)15-6-5-7-16(11-15)24(25)26/h5-11,22H,3-4,12-13H2,1-2H3InChIKey
OQJUAXWAECPZPF-UHFFFAOYSA-NSynonyms
CCOP(=O)(C1=C(OC(=N1)C2=CC(=CC=C2)(N+)(=O)(O))NCC3=CC4=C(C=C3)OCO4)OCC
CCOP(=O)(c1nc(oc1NCc1ccc2c(c1)OCO2)c1cccc(c1)(N+)(=O)(O))OCC
diethyl(5((13benzodioxol5ylmethyl)amino)2(3nitrophenyl)13oxazol4yl)phosphonate
InChI=1SC21H22N3O8Pc133033(273142)2120(221214891718(1014)29132817)3219(2321)1565716(1115)24(25)26h51122H341213H212H3
MFCD07425297
N(13benzodioxol5ylmethyl)4diethoxyphosphoryl2(3nitrophenyl)13oxazol5amine
ZINC000008868907
ZINC08868907
ZINC8868907
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