Vitas-M small molecule compound
2-acetylphenyl (1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)acetate
Catalog ID
STK258107
SMILES O=C(Oc1ccccc1C(=O)C)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 C21H19NO5 MW 365.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19NO5/c1-10(23)11-4-2-3-5-16(11)27-17(24)9-22-20(25)18-12-6-7-13(15-8-14(12)15)19(18)21(22)26/h2-7,12-15,18-19H,8-9H2,1H3InChIKey
LHGJBCACLIKDFZ-UHFFFAOYSA-NSynonyms
2acetylphenyl(13dioxooctahydro46ethenocyclopropa(f)isoindol2(1H)yl)acetate
CC(=O)C1=CC=CC=C1OC(=O)CN2C(=O)C3C4C=CC(C3C2=O)C5C4C5
InChI=1SC21H19NO5c110(23)11423516(11)2717(24)92220(25)18126713(15814(12)15)19(18)21(22)26h2712151819H89H21H3
MFCD03578130
ZINC000239338825
ZINC000239338828
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