Vitas-M small molecule compound
2-[4-(4-nitrophenoxy)phenyl]-2-oxoethyl 2-(1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)benzoate
Catalog ID
STK381238
SMILES O=C1C2C3C=CC(C2C(=O)N1c1ccccc1C(=O)OCC(=O)c1ccc(cc1)Oc1ccc(cc1)[N+](=O)[O-])C1C3C1
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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 C32H24N2O8 MW 564.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H24N2O8/c35-27(17-5-9-19(10-6-17)42-20-11-7-18(8-12-20)34(39)40)16-41-32(38)23-3-1-2-4-26(23)33-30(36)28-21-13-14-22(25-15-24(21)25)29(28)31(33)37/h1-14,21-22,24-25,28-29H,15-16H2InChIKey
QARBPNXGJOYPAN-UHFFFAOYSA-NSynonyms
2(4(4nitrophenoxy)phenyl)2oxoethyl2(13dioxooctahydro46ethenocyclopropa(f)isoindol2(1H)yl)benzoate
C1C2C1C3C=CC2C4C3C(=O)N(C4=O)C5=CC=CC=C5C(=O)OCC(=O)C6=CC=C(C=C6)OC7=CC=C(C=C7)(N+)(=O)(O)
InChI=1SC32H24N2O8c3527(175919(10617)422011718(81220)34(39)40)164132(38)23312426(23)3330(36)2821131422(251524(21)25)29(28)31(33)37h114212224252829H1516H2
MFCD02314706
O=C1C2C3C=CC(C2C(=O)N1c1ccccc1C(=O)OCC(=O)c1ccc(cc1)Oc1ccc(cc1)(N+)(=O)(O))C1C3C1
ZINC000239174435
ZINC000239174438
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