Vitas-M small molecule compound
dimethyl 1-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]-1H-1,2,3-triazole-4,5-dicarboxylate
Catalog ID
STL200299
SMILES COC(=O)c1n(nnc1C(=O)OC)CC(=O)c1ccc2c(c1)OCO2
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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 C15H13N3O7 MW 347.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13N3O7/c1-22-14(20)12-13(15(21)23-2)18(17-16-12)6-9(19)8-3-4-10-11(5-8)25-7-24-10/h3-5H,6-7H2,1-2H3InChIKey
BTWZJIYWJRUFRD-UHFFFAOYSA-NSynonyms
1403233-60-21403233602
45DIMETHYL1(2(2H13BENZODIOXOL5YL)2OXOETHYL)1H123TRIAZOLE45DICARBOXYLATE
COC(=O)C1=C(N(N=N1)CC(=O)C2=CC3=C(C=C2)OCO3)C(=O)OC
dimethyl1(2(13benzodioxol5yl)2oxoethyl)1H123triazole45dicarboxylate
dimethyl1(2(13benzodioxol5yl)2oxoethyl)triazole45dicarboxylate
InChI=1SC15H13N3O7c12214(20)1213(15(21)232)18(171612)69(19)8341011(58)2572410h35H67H212H3
MFCD22549282
ZINC000080316196
ZINC80316196
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