Vitas-M small molecule compound
1-(4-methylphenyl)-1-oxopropan-2-yl 6-nitro-2-oxo-2H-chromene-3-carboxylate
Catalog ID
STK358564
SMILES Cc1ccc(cc1)C(=O)C(OC(=O)c1cc2cc(ccc2oc1=O)[N+](=O)[O-])C
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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 C20H15NO7 MW 381.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15NO7/c1-11-3-5-13(6-4-11)18(22)12(2)27-19(23)16-10-14-9-15(21(25)26)7-8-17(14)28-20(16)24/h3-10,12H,1-2H3InChIKey
XRUIETFJVTWKIG-UHFFFAOYSA-NSynonyms
683248-30-8(1(4METHYLPHENYL)1OXOPROPAN2YL)6NITRO2OXOCHROMENE3CARBOXYLATE
1(4methylphenyl)1oxopropan2yl6nitro2oxo2Hchromene3carboxylate
1METHYL2(4METHYLPHENYL)2OXOETHYL6NITRO2OXOCHROMENE3CARBOXYLATE
683248308
6NITRO2OXO2HCHROMENE3CARBOXYLICACID1METHYL2OXO2PTOLYLETHYLESTER
CC1=CC=C(C=C1)C(=O)C(C)OC(=O)C2=CC3=C(C=CC(=C3)(N+)(=O)(O))OC2=O
Cc1ccc(cc1)C(=O)C(OC(=O)c1cc2cc(ccc2oc1=O)(N+)(=O)(O))C
InChI=1SC20H15NO7c1113513(6411)18(22)12(2)2719(23)161014915(21(25)26)7817(14)2820(16)24h31012H12H3
MFCD03039774
ZINC000000789081
ZINC000000789083
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