Vitas-M small molecule compound
(2Z)-3-oxo-2-(2,3,4-trimethoxybenzylidene)-2,3-dihydro-1-benzofuran-6-yl 4-nitrobenzoate
Catalog ID
STK568039
SMILES COc1ccc(c(c1OC)OC)/C=C/1\Oc2c(C1=O)ccc(c2)OC(=O)c1ccc(cc1)[N+](=O)[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 C25H19NO9 MW 477.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19NO9/c1-31-19-11-6-15(23(32-2)24(19)33-3)12-21-22(27)18-10-9-17(13-20(18)35-21)34-25(28)14-4-7-16(8-5-14)26(29)30/h4-13H,1-3H3/b21-12-InChIKey
IMEBADRXLWOMKR-MTJSOVHGSA-NSynonyms
622366-20-5((2Z)3OXO2((234TRIMETHOXYPHENYL)METHYLIDENE)1BENZOFURAN6YL)4NITROBENZOATE
(2Z)3oxo2(234trimethoxybenzylidene)23dihydro1benzofuran6yl4nitrobenzoate
(Z)3oxo2(234trimethoxybenzylidene)23dihydrobenzofuran6yl4nitrobenzoate
622366205
COC1=C(C(=C(C=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)C4=CC=C(C=C4)(N+)(=O)(O))OC)OC
COc1ccc(c(c1OC)OC)C=C1Oc2c(C1=O)ccc(c2)OC(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC25H19NO9c1311911615(23(322)24(19)333)122122(27)1810917(1320(18)3521)3425(28)144716(8514)26(29)30h413H13H3b2112
MFCD04187496
ZINC000001897019
ZINC01897019
ZINC1897019
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