Vitas-M small molecule compound
(2Z)-2-(3-methoxybenzylidene)-4-methyl-7-(morpholin-4-ium-4-ylmethyl)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STK607046
SMILES COc1cccc(c1)/C=C/1\Oc2c(C1=O)c(C)cc(c2C[NH+]1CCOCC1)[O-]
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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 C22H23NO5 MW 381.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23NO5/c1-14-10-18(24)17(13-23-6-8-27-9-7-23)22-20(14)21(25)19(28-22)12-15-4-3-5-16(11-15)26-2/h3-5,10-12,24H,6-9,13H2,1-2H3/b19-12-InChIKey
BLSSBNYUBUTMDZ-UNOMPAQXSA-NSynonyms
905431-52-9(2Z)2(3methoxybenzylidene)4methyl7(morpholin4ium4ylmethyl)3oxo23dihydro1benzofuran6olate
(2Z)6HYDROXY2((3METHOXYPHENYL)METHYLIDENE)4METHYL7(MORPHOLIN4YLMETHYL)1BENZOFURAN3ONE
6HYDROXY2((3METHOXYPHENYL)METHYLENE)4METHYL7(MORPHOLIN4YLMETHYL)BENZO(B)FURAN3ONE
COc1cccc(c1)C=C1Oc2c(C1=O)c(C)cc(c2C(NH+)1CCOCC1)(O)
MFCD08287748
ZINC000020573617
ZINC20573617
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