Vitas-M small molecule compound

phenyl 3-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)benzoate

Catalog ID
STK274755
SMILES O=C1N(c2cccc(c2)C(=O)Oc2ccccc2)C(=O)C2C1C1C=CC2C1

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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 C22H17NO4 MW 359.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17NO4/c24-20-18-13-9-10-14(11-13)19(18)21(25)23(20)16-6-4-5-15(12-16)22(26)27-17-7-2-1-3-8-17/h1-10,12-14,18-19H,11H2
InChIKey
WTDLRLZINVYIHQ-UHFFFAOYSA-N
Synonyms

C1C2C=CC1C3C2C(=O)N(C3=O)C4=CC=CC(=C4)C(=O)OC5=CC=CC=C5
InChI=1SC22H17NO4c2420181391014(1113)19(18)21(25)23(20)1664515(1216)22(26)27177213817h11012141819H11H2
MFCD03070724
phenyl3(13dioxo133a477ahexahydro2H47methanoisoindol2yl)benzoate
ZINC000102531987
ZINC000239235803

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Available files

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