Vitas-M small molecule compound
(2Z)-2-(furan-2-ylmethylidene)-4-methyl-3-oxo-7-(pyrrolidinium-1-ylmethyl)-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STK854813
SMILES Cc1cc([O-])c(c2c1C(=O)/C(=C/c1ccco1)/O2)C[NH+]1CCCC1
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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 C19H19NO4 MW 325.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19NO4/c1-12-9-15(21)14(11-20-6-2-3-7-20)19-17(12)18(22)16(24-19)10-13-5-4-8-23-13/h4-5,8-10,21H,2-3,6-7,11H2,1H3/b16-10-InChIKey
CVFZSUQNCBMEMB-YBEGLDIGSA-NSynonyms
903853-12-3(2Z)2(furan2ylmethylidene)4methyl3oxo7(pyrrolidin1ium1ylmethyl)1benzofuran6olate
(2Z)2(furan2ylmethylidene)4methyl3oxo7(pyrrolidinium1ylmethyl)23dihydro1benzofuran6olate
903853123
CC1=CC(=C(C2=C1C(=O)C(=CC3=CC=CO3)O2)C(NH+)4CCCC4)(O)
Cc1cc((O))c(c2c1C(=O)C(=Cc1ccco1)O2)C(NH+)1CCCC1
InChI=1SC19H19NO4c112915(21)14(1120623720)1917(12)18(22)16(2419)10135482313h4581021H236711H21H3b1610
MFCD08289817
ZINC000020589273
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