Vitas-M small molecule compound
3-bromo-5-ethoxy-4-[(4-nitrobenzyl)oxy]benzoic acid
Catalog ID
STL426650
SMILES CCOc1cc(cc(c1OCc1ccc(cc1)[N+](=O)[O-])Br)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 C16H14BrNO6 MW 396.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14BrNO6/c1-2-23-14-8-11(16(19)20)7-13(17)15(14)24-9-10-3-5-12(6-4-10)18(21)22/h3-8H,2,9H2,1H3,(H,19,20)InChIKey
ZSQLNSBOECWBQY-UHFFFAOYSA-NSynonyms
938303-55-03bromo5ethoxy4((4nitrobenzyl)oxy)benzoicacid
3BROMO5ETHOXY4((4NITROPHENYL)METHOXY)BENZOICACID
938303550
CCOC1=C(C(=CC(=C1)C(=O)O)Br)OCC2=CC=C(C=C2)(N+)(=O)(O)
CCOc1cc(cc(c1OCc1ccc(cc1)(N+)(=O)(O))Br)C(=O)O
InChI=1SC16H14BrNO6c122314811(16(19)20)713(17)15(14)249103512(6410)18(21)22h38H29H21H3(H1920)
MFCD09715765
ZINC000007603957
ZINC7603957
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