Vitas-M small molecule compound
5-{5-[(1E)-2-cyano-3-ethoxy-3-oxoprop-1-en-1-yl]furan-2-yl}benzene-1,3-dicarboxylic acid
Catalog ID
STK287110
SMILES CCOC(=O)/C(=C/c1ccc(o1)c1cc(cc(c1)C(=O)O)C(=O)O)/C#N
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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 C18H13NO7 MW 355.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13NO7/c1-2-25-18(24)13(9-19)8-14-3-4-15(26-14)10-5-11(16(20)21)7-12(6-10)17(22)23/h3-8H,2H2,1H3,(H,20,21)(H,22,23)/b13-8+InChIKey
BVUYCWYNZAVJBF-MDWZMJQESA-NSynonyms
5(5((1E)2CYANO2(ETHOXYCARBONYL)VINYL)2FURYL)BENZENE13DICARBOXYLICACID
5(5((1E)2cyano3ethoxy3oxoprop1en1yl)furan2yl)benzene13dicarboxylicacid
5(5((E)2CYANO3ETHOXY3OXOPROP1ENYL)FURAN2YL)BENZENE13DICARBOXYLICACID
CCOC(=O)C(=CC1=CC=C(O1)C2=CC(=CC(=C2)C(=O)O)C(=O)O)C#N
CCOC(=O)C(=Cc1ccc(o1)c1cc(cc(c1)C(=O)O)C(=O)O)C#N
InChI=1SC18H13NO7c122518(24)13(919)8143415(2614)10511(16(20)21)712(610)17(22)23h38H2H21H3(H2021)(H2223)b138+
MFCD03925088
ZINC000004544214
ZINC4544214
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