Vitas-M small molecule compound
4-({2-bromo-4-[(E)-(hydroxyimino)methyl]-6-methoxyphenoxy}methyl)benzoic acid
Catalog ID
STK113097
SMILES O/N=C/c1cc(Br)c(c(c1)OC)OCc1ccc(cc1)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 C16H14BrNO5 MW 380.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14BrNO5/c1-22-14-7-11(8-18-21)6-13(17)15(14)23-9-10-2-4-12(5-3-10)16(19)20/h2-8,21H,9H2,1H3,(H,19,20)/b18-8+InChIKey
IBDYWNVDUHBEBW-QGMBQPNBSA-NSynonyms
4((2BROMO4((E)(HYDROXYIMINO)METHYL)6METHOXYPHENOXY)METHYL)BENZOICACID
4((2bromo4((E)hydroxyiminomethyl)6methoxyphenoxy)methyl)benzoicacid
COC1=C(C(=CC(=C1)C=NO)Br)OCC2=CC=C(C=C2)C(=O)O
InChI=1SC16H14BrNO5c12214711(81821)613(17)15(14)239102412(5310)16(19)20h2821H9H21H3(H1920)b188+
MFCD04127564
ON=Cc1cc(Br)c(c(c1)OC)OCc1ccc(cc1)C(=O)O
ZINC000004689960
ZINC34869438
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