Vitas-M small molecule compound
(2Z)-2-(3-nitrobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl 3-methoxybenzoate
Catalog ID
STK923754
SMILES COc1cccc(c1)C(=O)Oc1ccc2c(c1)O/C(=C\c1cccc(c1)[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 C23H15NO7 MW 417.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H15NO7/c1-29-17-7-3-5-15(12-17)23(26)30-18-8-9-19-20(13-18)31-21(22(19)25)11-14-4-2-6-16(10-14)24(27)28/h2-13H,1H3/b21-11-InChIKey
VTIUPAYWAXRWNI-NHDPSOOVSA-NSynonyms
673498-02-7((2Z)2((3NITROPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)3METHOXYBENZOATE
(2Z)2(3nitrobenzylidene)3oxo23dihydro1benzofuran6yl3methoxybenzoate
(Z)2(3nitrobenzylidene)3oxo23dihydrobenzofuran6yl3methoxybenzoate
2((3NITROPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YL3METHOXYBENZOATE
673498027
COC1=CC=CC(=C1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CC4=CC(=CC=C4)(N+)(=O)(O))O3
COc1cccc(c1)C(=O)Oc1ccc2c(c1)OC(=Cc1cccc(c1)(N+)(=O)(O))C2=O
InChI=1SC23H15NO7c1291773515(1217)23(26)3018891920(1318)3121(22(19)25)111442616(1014)24(27)28h213H1H3b2111
MFCD04080810
ZINC000009215567
ZINC09215567
ZINC9215567
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