Vitas-M small molecule compound
4-{(Z)-[2-(2-chloro-5-nitrophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}-2-methoxyphenyl acetate
Catalog ID
STK747170
SMILES COc1cc(ccc1OC(=O)C)/C=C/1\N=C(OC1=O)c1cc(ccc1Cl)[N+](=O)[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 C19H13ClN2O7 MW 416.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13ClN2O7/c1-10(23)28-16-6-3-11(8-17(16)27-2)7-15-19(24)29-18(21-15)13-9-12(22(25)26)4-5-14(13)20/h3-9H,1-2H3/b15-7-InChIKey
XXRLBMZKAWWMJK-CHHVJCJISA-NSynonyms
(4((Z)(2(2CHLORO5NITROPHENYL)5OXO13OXAZOL4YLIDENE)METHYL)2METHOXYPHENYL)ACETATE
4((2(2CHLORO5NITROPHENYL)5OXO13OXAZOL4(5H)YLIDENE)METHYL)2METHOXYPHENYLACETATE
4((Z)(2(2chloro5nitrophenyl)5oxo13oxazol4(5H)ylidene)methyl)2methoxyphenylacetate
CC(=O)OC1=C(C=C(C=C1)C=C2C(=O)OC(=N2)C3=C(C=CC(=C3)(N+)(=O)(O))Cl)OC
COc1cc(ccc1OC(=O)C)C=C1N=C(OC1=O)c1cc(ccc1Cl)(N+)(=O)(O)
InChI=1SC19H13ClN2O7c110(23)28166311(817(16)272)71519(24)2918(2115)13912(22(25)26)4514(13)20h39H12H3b157
MFCD00565486
ZINC000000675732
ZINC00675732
ZINC675732
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