Vitas-M small molecule compound

propyl 3-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)benzoate

Catalog ID
STK358793
SMILES CCCOC(=O)c1cccc(c1)N1C(=O)C2C(C1=O)CC=CC2

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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 C18H19NO4 MW 313.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19NO4/c1-2-10-23-18(22)12-6-5-7-13(11-12)19-16(20)14-8-3-4-9-15(14)17(19)21/h3-7,11,14-15H,2,8-10H2,1H3
InChIKey
WSMLUFBVHVVRLX-UHFFFAOYSA-N
Synonyms

CCCOC(=O)C1=CC(=CC=C1)N2C(=O)C3CC=CCC3C2=O
InChI=1SC18H19NO4c12102318(22)1265713(1112)1916(20)14834915(14)17(19)21h37111415H2810H21H3
MFCD01062898
propyl3(13dioxo133a477ahexahydro2Hisoindol2yl)benzoate
PROPYL3(13DIOXO3A477ATETRAHYDROISOINDOL2YL)BENZOATE
PROPYL3(13DIOXO473A7ATETRAHYDROISOINDOL2YL)BENZOATE
ZINC000015938545
ZINC000102063880

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Available files

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