Vitas-M small molecule compound

1-(2-{[(2,4-dihydroxyphenyl)carbonyl]oxy}ethyl)-1-methylpiperidinium

Catalog ID
STK021219
SMILES Oc1ccc(c(c1)O)C(=O)OCC[N+]1(C)CCCCC1

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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 C15H22NO4 MW 280.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H21NO4/c1-16(7-3-2-4-8-16)9-10-20-15(19)13-6-5-12(17)11-14(13)18/h5-6,11H,2-4,7-10H2,1H3,(H-,17,18,19)/p+1
InChIKey
NWJQFDHXMIJTKQ-UHFFFAOYSA-O
Synonyms

1(2(((24DIHYDROXYPHENYL)CARBONYL)OXY)ETHYL)1METHYLPIPERIDINIUM
1(2((24dihydroxybenzoyl)oxy)ethyl)1methylpiperidin1iumiodide
2(1METHYLPIPERIDIN1IUM1YL)ETHYL24DIHYDROXYBENZOATE
C(N+)1(CCCCC1)CCOC(=O)C2=C(C=C(C=C2)O)O
InChI=1SC15H21NO4c116(7324816)9102015(19)136512(17)1114(13)18h5611H24710H21H3(H171819)p+1
MFCD01550465
Oc1ccc(c(c1)O)C(=O)OCC(N+)1(C)CCCCC1
Oc1ccc(c(c1)O)C(=O)OCC(N+)1(C)CCCCC1(I)
STK021219
ZINC000000492442
ZINC00492442
ZINC492442

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Available files

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