Vitas-M small molecule compound

2-(2-methylpiperidin-1-yl)-5-nitrobenzoic acid

Catalog ID
STL554005
SMILES CC1CCCCN1c1ccc(cc1C(=O)O)[N+](=O)[O-]

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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 C13H16N2O4 MW 264.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16N2O4/c1-9-4-2-3-7-14(9)12-6-5-10(15(18)19)8-11(12)13(16)17/h5-6,8-9H,2-4,7H2,1H3,(H,16,17)
InChIKey
ARCGWSIHHQVAJL-UHFFFAOYSA-N
Synonyms

10659245
2(2methylpiperidin1yl)5nitrobenzoicacid
InChI=1SC13H16N2O4c19423714(9)126510(15(18)19)811(12)13(16)17h5689H247H21H3(H1617)
MFCD11040058
ZINC000019844572
ZINC000019844573

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Available files

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