Vitas-M small molecule compound
3-ethoxy-4-[(3-nitrobenzyl)oxy]benzoic acid
Catalog ID
STL426742
SMILES CCOc1cc(ccc1OCc1cccc(c1)[N+](=O)[O-])C(=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 C16H15NO6 MW 317.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15NO6/c1-2-22-15-9-12(16(18)19)6-7-14(15)23-10-11-4-3-5-13(8-11)17(20)21/h3-9H,2,10H2,1H3,(H,18,19)InChIKey
LFHKGUVUSYSLAQ-UHFFFAOYSA-NSynonyms
3ethoxy4((3nitrobenzyl)oxy)benzoicacid
3ethoxy4((3nitrophenyl)methoxy)benzoicacid
CCOC1=C(C=CC(=C1)C(=O)O)OCC2=CC(=CC=C2)(N+)(=O)(O)
CCOc1cc(ccc1OCc1cccc(c1)(N+)(=O)(O))C(=O)O
InChI=1SC16H15NO6c122215912(16(18)19)6714(15)23101143513(811)17(20)21h39H210H21H3(H1819)
MFCD29036263
ZINC000227156705
ZINC227156705
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