Vitas-M small molecule compound
diethyl [1-(6,7-dimethoxy-1,3-benzodioxol-5-yl)-2-nitroethyl]propanedioate
Catalog ID
STL433529
SMILES CCOC(=O)C(C(c1cc2OCOc2c(c1OC)OC)C[N+](=O)[O-])C(=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 C18H23NO10 MW 413.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23NO10/c1-5-26-17(20)13(18(21)27-6-2)11(8-19(22)23)10-7-12-15(29-9-28-12)16(25-4)14(10)24-3/h7,11,13H,5-6,8-9H2,1-4H3InChIKey
VTGCMYUZRLWSEB-UHFFFAOYSA-NSynonyms
CCOC(=O)C(C(C(N+)(=O)(O))C1=CC2=C(C(=C1OC)OC)OCO2)C(=O)OCC
CCOC(=O)C(C(c1cc2OCOc2c(c1OC)OC)C(N+)(=O)(O))C(=O)OCC
diethyl(1(67dimethoxy13benzodioxol5yl)2nitroethyl)propanedioate
diethyl2(1(67dimethoxy13benzodioxol5yl)2nitroethyl)propanedioate
InChI=1SC18H23NO10c152617(20)13(18(21)2762)11(819(22)23)1071215(2992812)16(254)14(10)243h71113H5689H214H3
MFCD25975906
ZINC000066091339
ZINC000066091340
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