Vitas-M small molecule compound
dimethyl 2-{[(1E)-3-(1,3-benzodioxol-5-yl)-3-oxoprop-1-en-1-yl]amino}benzene-1,4-dicarboxylate
Catalog ID
STK902262
SMILES COC(=O)c1ccc(cc1N/C=C/C(=O)c1ccc2c(c1)OCO2)C(=O)OC
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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 C20H17NO7 MW 383.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17NO7/c1-25-19(23)13-3-5-14(20(24)26-2)15(9-13)21-8-7-16(22)12-4-6-17-18(10-12)28-11-27-17/h3-10,21H,11H2,1-2H3/b8-7+InChIKey
CMWKVQLMDDHAKY-BQYQJAHWSA-NSynonyms
COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC=CC(=O)C2=CC3=C(C=C2)OCO3
COC(=O)c1ccc(cc1NC=CC(=O)c1ccc2c(c1)OCO2)C(=O)OC
dimethyl2(((1E)3(13benzodioxol5yl)3oxoprop1en1yl)amino)benzene14dicarboxylate
dimethyl2(((E)3(13benzodioxol5yl)3oxoprop1enyl)amino)benzene14dicarboxylate
InChI=1SC20H17NO7c12519(23)133514(20(24)262)15(913)218716(22)12461718(1012)28112717h31021H11H212H3b87+
MFCD18174788
ZINC000044842564
ZINC44842564
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