Vitas-M small molecule compound
(2Z)-2-(4-nitrobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl 3,4,5-trimethoxybenzoate
Catalog ID
STK924411
SMILES COc1cc(cc(c1OC)OC)C(=O)Oc1ccc2c(c1)O/C(=C\c1ccc(cc1)[N+](=O)[O-])/C2=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/c1-31-21-11-15(12-22(32-2)24(21)33-3)25(28)34-17-8-9-18-19(13-17)35-20(23(18)27)10-14-4-6-16(7-5-14)26(29)30/h4-13H,1-3H3/b20-10-InChIKey
IOUMTFXKMIQJTO-JMIUGGIZSA-NSynonyms
622798-25-8((2Z)2((4NITROPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)345TRIMETHOXYBENZOATE
(2Z)2(4nitrobenzylidene)3oxo23dihydro1benzofuran6yl345trimethoxybenzoate
(Z)2(4nitrobenzylidene)3oxo23dihydrobenzofuran6yl345trimethoxybenzoate
2((4NITROPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YL345TRIMETHOXYBENZOATE
622798258
COC1=CC(=CC(=C1OC)OC)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CC4=CC=C(C=C4)(N+)(=O)(O))O3
COc1cc(cc(c1OC)OC)C(=O)Oc1ccc2c(c1)OC(=Cc1ccc(cc1)(N+)(=O)(O))C2=O
InChI=1SC25H19NO9c131211115(1222(322)24(21)333)25(28)3417891819(1317)3520(23(18)27)10144616(7514)26(29)30h413H13H3b2010
MFCD04176144
ZINC000009359435
ZINC09359435
ZINC9359435
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