Vitas-M small molecule compound
ethyl 4-{[(1E)-3-(1,3-benzodioxol-5-yl)-3-oxoprop-1-en-1-yl]amino}benzoate
Catalog ID
STK902260
SMILES CCOC(=O)c1ccc(cc1)N/C=C/C(=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 C19H17NO5 MW 339.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17NO5/c1-2-23-19(22)13-3-6-15(7-4-13)20-10-9-16(21)14-5-8-17-18(11-14)25-12-24-17/h3-11,20H,2,12H2,1H3/b10-9+InChIKey
WCRNJFBMDPWTAY-MDZDMXLPSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC=CC(=O)C2=CC3=C(C=C2)OCO3
CCOC(=O)c1ccc(cc1)NC=CC(=O)c1ccc2c(c1)OCO2
ethyl4(((1E)3(13benzodioxol5yl)3oxoprop1en1yl)amino)benzoate
ethyl4(((E)3(13benzodioxol5yl)3oxoprop1enyl)amino)benzoate
InChI=1SC19H17NO5c122319(22)133615(7413)2010916(21)14581718(1114)25122417h31120H212H21H3b109+
MFCD18174786
ZINC000005796446
ZINC05796446
ZINC5796446
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