Vitas-M small molecule compound

2-oxo-2-phenylethyl 2-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-phenylpropanoate

Catalog ID
STK253007
SMILES O=C(C(N1C(=O)c2c(C1=O)cccc2[N+](=O)[O-])Cc1ccccc1)OCC(=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/c28-21(17-10-5-2-6-11-17)15-34-25(31)20(14-16-8-3-1-4-9-16)26-23(29)18-12-7-13-19(27(32)33)22(18)24(26)30/h1-13,20H,14-15H2
InChIKey
HDKXSFDZYFPGOF-UHFFFAOYSA-N
Synonyms

2OXO2PHENYLETHYL(2R)2(4NITRO13DIOXO13DIHYDRO2HISOINDOL2YL)3PHENYLPROPANOATE
2OXO2PHENYLETHYL(2S)2(4NITRO13DIOXO13DIHYDRO2HISOINDOL2YL)3PHENYLPROPANOATE
2OXO2PHENYLETHYL2(4NITRO13DIOXO13DIHYDRO2HISOINDOL2YL)3PHENYLPROPANOATE
2OXO2PHENYLETHYL2(4NITRO13DIOXOBENZO(C)AZOLIN2YL)3PHENYLPROPANOATE
C1=CC=C(C=C1)CC(C(=O)OCC(=O)C2=CC=CC=C2)N3C(=O)C4=C(C3=O)C(=CC=C4)(N+)(=O)(O)
InChI=1SC25H18N2O7c2821(17105261117)153425(31)20(14168314916)2623(29)181271319(27(32)33)22(18)24(26)30h11320H1415H2
MFCD02614281
O=C(C(N1C(=O)c2c(C1=O)cccc2(N+)(=O)(O))Cc1ccccc1)OCC(=O)c1ccccc1
PHENACYL2(4NITRO13DIOXOISOINDOL2YL)3PHENYLPROPANOATE
ZINC000000971811
ZINC000000971812

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.