Vitas-M small molecule compound
(2Z)-3-oxo-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydro-1-benzofuran-6-yl 3-nitrobenzoate
Catalog ID
STK853075
SMILES COc1cc(/C=C/2\Oc3c(C2=O)ccc(c3)OC(=O)c2cccc(c2)[N+](=O)[O-])cc(c1OC)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 C25H19NO9 MW 477.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19NO9/c1-31-21-10-14(11-22(32-2)24(21)33-3)9-20-23(27)18-8-7-17(13-19(18)35-20)34-25(28)15-5-4-6-16(12-15)26(29)30/h4-13H,1-3H3/b20-9-InChIKey
PGFFRAFPVAEHMN-UKWGHVSLSA-NSynonyms
892625-87-5((2Z)3OXO2((345TRIMETHOXYPHENYL)METHYLIDENE)1BENZOFURAN6YL)3NITROBENZOATE
(2Z)3oxo2(345trimethoxybenzylidene)23dihydro1benzofuran6yl3nitrobenzoate
(Z)3oxo2(345trimethoxybenzylidene)23dihydrobenzofuran6yl3nitrobenzoate
3OXO2((345TRIMETHOXYPHENYL)METHYLENE)BENZO(34B)FURAN6YL3NITROBENZOATE
892625875
COC1=CC(=CC(=C1OC)OC)C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)C4=CC(=CC=C4)(N+)(=O)(O)
COc1cc(C=C2Oc3c(C2=O)ccc(c3)OC(=O)c2cccc(c2)(N+)(=O)(O))cc(c1OC)OC
InChI=1SC25H19NO9c131211014(1122(322)24(21)333)92023(27)188717(1319(18)3520)3425(28)1554616(1215)26(29)30h413H13H3b209
MFCD06791221
ZINC000009011699
ZINC09011699
ZINC9011699
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