Vitas-M small molecule compound

2-oxo-2-phenylethyl 2-(1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)propanoate

Catalog ID
STK257709
SMILES O=C(C(N1C(=O)C2C(C1=O)C1C=CC2C2C1C2)C)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 C22H21NO5 MW 379.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO5/c1-11(22(27)28-10-17(24)12-5-3-2-4-6-12)23-20(25)18-13-7-8-14(16-9-15(13)16)19(18)21(23)26/h2-8,11,13-16,18-19H,9-10H2,1H3
InChIKey
XBYDBYCAEPUJOU-UHFFFAOYSA-N
Synonyms

2OXO2PHENYLETHYL2(13DIOXOOCTAHYDRO46ETHENOCYCLOPROPA(F)ISOINDOL2(1H)YL)PROPANOATE
CC(C(=O)OCC(=O)C1=CC=CC=C1)N2C(=O)C3C4C=CC(C3C2=O)C5C4C5
InChI=1SC22H21NO5c111(22(27)281017(24)125324612)2320(25)18137814(16915(13)16)19(18)21(23)26h281113161819H910H21H3
MFCD02916161
ZINC000239433005
ZINC000239433008

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Available files

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