Vitas-M small molecule compound
(2Z)-2-(4-nitrobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl 2,6-dimethoxybenzoate
Catalog ID
STK924432
SMILES COc1cccc(c1C(=O)Oc1ccc2c(c1)O/C(=C\c1ccc(cc1)[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/c1-30-18-4-3-5-19(31-2)22(18)24(27)32-16-10-11-17-20(13-16)33-21(23(17)26)12-14-6-8-15(9-7-14)25(28)29/h3-13H,1-2H3/b21-12-InChIKey
JPCBEVLCQBFFPG-MTJSOVHGSA-NSynonyms
622795-87-3((2Z)2((4NITROPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)26DIMETHOXYBENZOATE
(2Z)2(4nitrobenzylidene)3oxo23dihydro1benzofuran6yl26dimethoxybenzoate
(Z)2(4nitrobenzylidene)3oxo23dihydrobenzofuran6yl26dimethoxybenzoate
2((4NITROPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YL26DIMETHOXYBENZOATE
622795873
COC1=C(C(=CC=C1)OC)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CC4=CC=C(C=C4)(N+)(=O)(O))O3
COc1cccc(c1C(=O)Oc1ccc2c(c1)OC(=Cc1ccc(cc1)(N+)(=O)(O))C2=O)OC
InChI=1SC24H17NO8c1301843519(312)22(18)24(27)321610111720(1316)3321(23(17)26)12146815(9714)25(28)29h313H12H3b2112
MFCD04189175
ZINC000009289319
ZINC09289319
ZINC9289319
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