Vitas-M small molecule compound
bis(2-methylpropyl) 3,3'-[carbonylbis(1,3-dioxo-1,3-dihydro-2H-isoindole-5,2-diyl)]dibenzoate
Catalog ID
STK267621
SMILES CC(COC(=O)c1cccc(c1)N1C(=O)c2c(C1=O)cc(cc2)C(=O)c1ccc2c(c1)C(=O)N(C2=O)c1cccc(c1)C(=O)OCC(C)C)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 C39H32N2O9 MW 672.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C39H32N2O9/c1-21(2)19-49-38(47)25-7-5-9-27(15-25)40-34(43)29-13-11-23(17-31(29)36(40)45)33(42)24-12-14-30-32(18-24)37(46)41(35(30)44)28-10-6-8-26(16-28)39(48)50-20-22(3)4/h5-18,21-22H,19-20H2,1-4H3InChIKey
BENPKHQKAOMEHY-UHFFFAOYSA-NSynonyms
2METHYLPROPYL3(5(2(3(2METHYLPROPOXYCARBONYL)PHENYL)13DIOXOISOINDOLE5CARBONYL)13DIOXOISOINDOL2YL)BENZOATE
bis(2methylpropyl)33(carbonylbis(13dioxo13dihydro2Hisoindole52diyl))dibenzoate
CC(C)COC(=O)C1=CC(=CC=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)C4=CC5=C(C=C4)C(=O)N(C5=O)C6=CC=CC(=C6)C(=O)OCC(C)C
InChI=1SC39H32N2O9c121(2)194938(47)2575927(1525)4034(43)29131123(1731(29)36(40)45)33(42)2412143032(1824)37(46)41(35(30)44)28106826(1628)39(48)502022(3)4h5182122H1920H214H3
MFCD00301779
ZINC000150387360
ZINC150387360
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