Vitas-M small molecule compound
2-ethoxy-4-[(E)-(5-oxo-2-phenyl-1,3-oxazol-4(5H)-ylidene)methyl]phenyl 3-nitrobenzoate
Catalog ID
STK100355
SMILES CCOc1cc(ccc1OC(=O)c1cccc(c1)[N+](=O)[O-])/C=C\1/N=C(OC1=O)c1ccccc1
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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 C25H18N2O7 MW 458.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18N2O7/c1-2-32-22-14-16(13-20-25(29)34-23(26-20)17-7-4-3-5-8-17)11-12-21(22)33-24(28)18-9-6-10-19(15-18)27(30)31/h3-15H,2H2,1H3/b20-13+InChIKey
ITANTYBRALSNJU-DEDYPNTBSA-NSynonyms
(2ETHOXY4((E)(5OXO2PHENYL13OXAZOL4YLIDENE)METHYL)PHENYL)3NITROBENZOATE
2ETHOXY4((E)(5OXO2PHENYL13OXAZOL4(5H)YLIDENE)METHYL)PHENYL3NITROBENZOATE
CCOC1=C(C=CC(=C1)C=C2C(=O)OC(=N2)C3=CC=CC=C3)OC(=O)C4=CC(=CC=C4)(N+)(=O)(O)
CCOc1cc(ccc1OC(=O)c1cccc(c1)(N+)(=O)(O))C=C1N=C(OC1=O)c1ccccc1
InChI=1SC25H18N2O7c1232221416(132025(29)3423(2620)177435817)111221(22)3324(28)18961019(1518)27(30)31h315H2H21H3b2013+
MFCD03227993
ZINC000001171087
ZINC01171087
ZINC1171087
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