Vitas-M small molecule compound
4-{(E)-[2-(3-chlorophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl 3-nitrobenzoate
Catalog ID
STK081154
SMILES Clc1cccc(c1)C1=N/C(=C/c2ccc(cc2)OC(=O)c2cccc(c2)[N+](=O)[O-])/C(=O)O1
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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 C23H13ClN2O6 MW 448.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H13ClN2O6/c24-17-5-1-3-15(12-17)21-25-20(23(28)32-21)11-14-7-9-19(10-8-14)31-22(27)16-4-2-6-18(13-16)26(29)30/h1-13H/b20-11+InChIKey
GAHSAJMBXCYYOE-RGVLZGJSSA-NSynonyms
(4((E)(2(3CHLOROPHENYL)5OXO13OXAZOL4YLIDENE)METHYL)PHENYL)3NITROBENZOATE
4((E)(2(3CHLOROPHENYL)5OXO13OXAZOL4(5H)YLIDENE)METHYL)PHENYL3NITROBENZOATE
C1=CC(=CC(=C1)Cl)C2=NC(=CC3=CC=C(C=C3)OC(=O)C4=CC(=CC=C4)(N+)(=O)(O))C(=O)O2
Clc1cccc(c1)C1=NC(=Cc2ccc(cc2)OC(=O)c2cccc(c2)(N+)(=O)(O))C(=O)O1
InChI=1SC23H13ClN2O6c241751315(1217)212520(23(28)3221)11147919(10814)3122(27)1642618(1316)26(29)30h113Hb2011+
MFCD03032576
STK081154
ZINC000002955875
ZINC02955875
ZINC2955875
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