Vitas-M small molecule compound
butyl 4-{5-[(1E)-3-amino-3-oxoprop-1-en-1-yl]furan-2-yl}benzoate
Catalog ID
STL508026
SMILES CCCCOC(=O)c1ccc(cc1)c1ccc(o1)/C=C/C(=O)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 C18H19NO4 MW 313.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19NO4/c1-2-3-12-22-18(21)14-6-4-13(5-7-14)16-10-8-15(23-16)9-11-17(19)20/h4-11H,2-3,12H2,1H3,(H2,19,20)/b11-9+InChIKey
HOOPLWMPVCAKIQ-PKNBQFBNSA-NSynonyms
132452361
butyl4(5((~(E))3amino3oxoprop1enyl)furan2yl)benzoate
butyl4(5((1E)3amino3oxoprop1en1yl)furan2yl)benzoate
InChI=1SC18H19NO4c123122218(21)146413(5714)1610815(2316)91117(19)20h411H2312H21H3(H21920)b119+
MFCD31551698
ZINC000675030704
ZINC000675030705
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