Vitas-M small molecule compound

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

Catalog ID
STK258489
SMILES CC(N1C(=O)C2C(C1=O)C1C=CC2C2C1C2)C(=O)Oc1ccccc1

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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 C20H19NO4 MW 337.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19NO4/c1-10(20(24)25-11-5-3-2-4-6-11)21-18(22)16-12-7-8-13(15-9-14(12)15)17(16)19(21)23/h2-8,10,12-17H,9H2,1H3
InChIKey
LWZSVFTYNRUTCR-UHFFFAOYSA-N
Synonyms

CC(C(=O)OC1=CC=CC=C1)N2C(=O)C3C4C=CC(C3C2=O)C5C4C5
InChI=1SC20H19NO4c110(20(24)25115324611)2118(22)16127813(15914(12)15)17(16)19(21)23h28101217H9H21H3
MFCD03578119
phenyl2(13dioxooctahydro46ethenocyclopropa(f)isoindol2(1H)yl)propanoate
ZINC000239339242
ZINC000239339245

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.