Vitas-M small molecule compound
2-(4-methyl-3-nitrophenyl)-2-oxoethyl 2-(4-methoxyphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate
Catalog ID
STK358831
SMILES COc1ccc(cc1)N1C(=O)c2c(C1=O)cc(cc2)C(=O)OCC(=O)c1ccc(c(c1)[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 C25H18N2O8 MW 474.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18N2O8/c1-14-3-4-15(12-21(14)27(32)33)22(28)13-35-25(31)16-5-10-19-20(11-16)24(30)26(23(19)29)17-6-8-18(34-2)9-7-17/h3-12H,13H2,1-2H3InChIKey
OKJQDFINPJOJPD-UHFFFAOYSA-NSynonyms
(2(4METHYL3NITROPHENYL)2OXOETHYL)2(4METHOXYPHENYL)13DIOXOISOINDOLE5CARBOXYLATE
2(4methyl3nitrophenyl)2oxoethyl2(4methoxyphenyl)13dioxo23dihydro1Hisoindole5carboxylate
CC1=C(C=C(C=C1)C(=O)COC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=C(C=C4)OC)(N+)(=O)(O)
COc1ccc(cc1)N1C(=O)c2c(C1=O)cc(cc2)C(=O)OCC(=O)c1ccc(c(c1)(N+)(=O)(O))C
InChI=1SC25H18N2O8c1143415(1221(14)27(32)33)22(28)133525(31)165101920(1116)24(30)26(23(19)29)176818(342)9717h312H13H212H3
MFCD02318415
ZINC000001171052
ZINC01171052
ZINC1171052
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