Vitas-M small molecule compound

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

Catalog ID
STK286518
SMILES O=C1N(c2cccc(c2)C(=O)Oc2ccc(cc2)Cc2ccccc2)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 C29H23NO4 MW 449.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23NO4/c31-27-25-20-11-12-21(16-20)26(25)28(32)30(27)23-8-4-7-22(17-23)29(33)34-24-13-9-19(10-14-24)15-18-5-2-1-3-6-18/h1-14,17,20-21,25-26H,15-16H2
InChIKey
VBSHYQKXYIZILX-UHFFFAOYSA-N
Synonyms

4benzylphenyl3(13dioxo133a477ahexahydro2H47methanoisoindol2yl)benzoate
C1C2C=CC1C3C2C(=O)N(C3=O)C4=CC=CC(=C4)C(=O)OC5=CC=C(C=C5)CC6=CC=CC=C6
InChI=1SC29H23NO4c31272520111221(1620)26(25)28(32)30(27)2384722(1723)29(33)342413919(101424)15185213618h1141720212526H1516H2
MFCD03577438
ZINC000100952313
ZINC000239231176

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Available files

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