Vitas-M small molecule compound
(2Z)-2-(3-nitrobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl 4-methylbenzoate
Catalog ID
STK923581
SMILES Cc1ccc(cc1)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 C23H15NO6 MW 401.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H15NO6/c1-14-5-7-16(8-6-14)23(26)29-18-9-10-19-20(13-18)30-21(22(19)25)12-15-3-2-4-17(11-15)24(27)28/h2-13H,1H3/b21-12-InChIKey
PKXOTTZLOCMFFR-MTJSOVHGSA-NSynonyms
674357-89-2((2Z)2((3NITROPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)4METHYLBENZOATE
(2Z)2(3nitrobenzylidene)3oxo23dihydro1benzofuran6yl4methylbenzoate
(Z)2(3nitrobenzylidene)3oxo23dihydrobenzofuran6yl4methylbenzoate
2((3NITROPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YL4METHYLBENZOATE
674357892
CC1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CC4=CC(=CC=C4)(N+)(=O)(O))O3
Cc1ccc(cc1)C(=O)Oc1ccc2c(c1)OC(=Cc1cccc(c1)(N+)(=O)(O))C2=O
InChI=1SC23H15NO6c1145716(8614)23(26)29189101920(1318)3021(22(19)25)121532417(1115)24(27)28h213H1H3b2112
MFCD04073602
ZINC000005177816
ZINC05177816
ZINC5177816
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