Vitas-M small molecule compound
2-[4-(4-nitrophenoxy)phenyl]-2-oxoethyl (1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)acetate
Catalog ID
STK389001
SMILES O=C(c1ccc(cc1)Oc1ccc(cc1)[N+](=O)[O-])COC(=O)CN1C(=O)C2C(C1=O)C1C=CC2C2C1C2
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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 C27H22N2O8 MW 502.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N2O8/c30-22(14-1-5-16(6-2-14)37-17-7-3-15(4-8-17)29(34)35)13-36-23(31)12-28-26(32)24-18-9-10-19(21-11-20(18)21)25(24)27(28)33/h1-10,18-21,24-25H,11-13H2InChIKey
ZGKKPIWWHKICTN-UHFFFAOYSA-NSynonyms
1022545-67-01022545670
2(4(4nitrophenoxy)phenyl)2oxoethyl(13dioxooctahydro46ethenocyclopropa(f)isoindol2(1H)yl)acetate
C1C2C1C3C=CC2C4C3C(=O)N(C4=O)CC(=O)OCC(=O)C5=CC=C(C=C5)OC6=CC=C(C=C6)(N+)(=O)(O)
InChI=1SC27H22N2O8c3022(141516(6214)37177315(4817)29(34)35)133623(31)122826(32)241891019(211120(18)21)25(24)27(28)33h11018212425H1113H2
MFCD02314541
O=C(c1ccc(cc1)Oc1ccc(cc1)(N+)(=O)(O))COC(=O)CN1C(=O)C2C(C1=O)C1C=CC2C2C1C2
ZINC000239438967
ZINC000245226486
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