Vitas-M small molecule compound

2-(4-chlorophenyl)-2-oxoethyl (1,3-dioxo-5-phenyloctahydro-2H-4,7-methanoisoindol-2-yl)acetate

Catalog ID
STK264996
SMILES Clc1ccc(cc1)C(=O)COC(=O)CN1C(=O)C2C(C1=O)C1CC2C(C1)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 C25H22ClNO5 MW 451.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClNO5/c26-17-8-6-15(7-9-17)20(28)13-32-21(29)12-27-24(30)22-16-10-18(14-4-2-1-3-5-14)19(11-16)23(22)25(27)31/h1-9,16,18-19,22-23H,10-13H2
InChIKey
JVAGYIIXPNPQPD-UHFFFAOYSA-N
Synonyms

2(4chlorophenyl)2oxoethyl(13dioxo5phenyloctahydro2H47methanoisoindol2yl)acetate
C1C2CC(C1C3C2C(=O)N(C3=O)CC(=O)OCC(=O)C4=CC=C(C=C4)Cl)C5=CC=CC=C5
InChI=1SC25H22ClNO5c26178615(7917)20(28)133221(29)122724(30)22161018(144213514)19(1116)23(22)25(27)31h191618192223H1013H2
MFCD03849352
ZINC000102095730
ZINC000245226182

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Available files

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