Vitas-M small molecule compound

4-(1,3-dihydro-2H-isoindolium-2-yl)benzoate

Catalog ID
STL057628
SMILES [O-]C(=O)c1ccc(cc1)[NH+]1Cc2c(C1)cccc2

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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 C15H13NO2 MW 239.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13NO2/c17-15(18)11-5-7-14(8-6-11)16-9-12-3-1-2-4-13(12)10-16/h1-8H,9-10H2,(H,17,18)
InChIKey
YLWWJMYNWJSUNG-UHFFFAOYSA-N
Synonyms
329715-35-7
(O)C(=O)c1ccc(cc1)(NH+)1Cc2c(C1)cccc2
329715357
MFCD00755022
ZINC000000033845

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Available files

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