Vitas-M small molecule compound
(2Z)-2-(3-nitrobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl 2,6-dimethoxybenzoate
Catalog ID
STK923755
SMILES COc1cccc(c1C(=O)Oc1ccc2c(c1)O/C(=C\c1cccc(c1)[N+](=O)[O-])/C2=O)OC
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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 C24H17NO8 MW 447.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H17NO8/c1-30-18-7-4-8-19(31-2)22(18)24(27)32-16-9-10-17-20(13-16)33-21(23(17)26)12-14-5-3-6-15(11-14)25(28)29/h3-13H,1-2H3/b21-12-InChIKey
BOBQTVAERLXWRV-MTJSOVHGSA-NSynonyms
673489-70-8((2Z)2((3NITROPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)26DIMETHOXYBENZOATE
(2Z)2(3nitrobenzylidene)3oxo23dihydro1benzofuran6yl26dimethoxybenzoate
(Z)2(3nitrobenzylidene)3oxo23dihydrobenzofuran6yl26dimethoxybenzoate
2((3NITROPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YL26DIMETHOXYBENZOATE
673489708
COC1=C(C(=CC=C1)OC)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CC4=CC(=CC=C4)(N+)(=O)(O))O3
COc1cccc(c1C(=O)Oc1ccc2c(c1)OC(=Cc1cccc(c1)(N+)(=O)(O))C2=O)OC
InChI=1SC24H17NO8c1301874819(312)22(18)24(27)32169101720(1316)3321(23(17)26)121453615(1114)25(28)29h313H12H3b2112
MFCD04072497
ZINC000011868874
ZINC11868874
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