Vitas-M small molecule compound

phenyl 3-(5-methyl-1,3-dioxooctahydro-2H-isoindol-2-yl)benzoate

Catalog ID
STK274636
SMILES CC1CCC2C(C1)C(=O)N(C2=O)c1cccc(c1)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 C22H21NO4 MW 363.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO4/c1-14-10-11-18-19(12-14)21(25)23(20(18)24)16-7-5-6-15(13-16)22(26)27-17-8-3-2-4-9-17/h2-9,13-14,18-19H,10-12H2,1H3
InChIKey
VCZXULSCNXPJGH-UHFFFAOYSA-N
Synonyms

CC1CCC2C(C1)C(=O)N(C2=O)C3=CC=CC(=C3)C(=O)OC4=CC=CC=C4
InChI=1SC22H21NO4c11410111819(1214)21(25)23(20(18)24)1675615(1316)22(26)27178324917h2913141819H1012H21H3
MFCD02871158
phenyl3(5methyl13dioxo3a45677ahexahydroisoindol2yl)benzoate
phenyl3(5methyl13dioxooctahydro2Hisoindol2yl)benzoate
ZINC000017987159
ZINC000239231207

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Available files

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