Vitas-M small molecule compound
2-(4-nitrophenyl)-2-oxoethyl 3-(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)benzoate
Catalog ID
STK247334
SMILES O=C1N(c2cccc(c2)C(=O)OCC(=O)c2ccc(cc2)[N+](=O)[O-])C(=O)C2C1C1CCC2C1
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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 C24H20N2O7 MW 448.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20N2O7/c27-19(13-6-8-17(9-7-13)26(31)32)12-33-24(30)16-2-1-3-18(11-16)25-22(28)20-14-4-5-15(10-14)21(20)23(25)29/h1-3,6-9,11,14-15,20-21H,4-5,10,12H2InChIKey
CLOUJLCDLCKLFV-UHFFFAOYSA-NSynonyms
2(4NITROPHENYL)2OXOETHYL3(13DIOXOOCTAHYDRO2H47METHANOISOINDOL2YL)BENZOATE
C1CC2CC1C3C2C(=O)N(C3=O)C4=CC=CC(=C4)C(=O)OCC(=O)C5=CC=C(C=C5)(N+)(=O)(O)
InChI=1SC24H20N2O7c2719(136817(9713)26(31)32)123324(30)1621318(1116)2522(28)20144515(1014)21(20)23(25)29h13691114152021H451012H2
MFCD01156357
O=C1N(c2cccc(c2)C(=O)OCC(=O)c2ccc(cc2)(N+)(=O)(O))C(=O)C2C1C1CCC2C1
ZINC000100555640
ZINC000239030865
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