Vitas-M small molecule compound
methyl 6-bromo-2-methyl-5-[(3-nitrobenzyl)oxy]-1-benzofuran-3-carboxylate
Catalog ID
STK839992
SMILES COC(=O)c1c(C)oc2c1cc(OCc1cccc(c1)[N+](=O)[O-])c(c2)Br
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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 C18H14BrNO6 MW 420.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14BrNO6/c1-10-17(18(21)24-2)13-7-16(14(19)8-15(13)26-10)25-9-11-4-3-5-12(6-11)20(22)23/h3-8H,9H2,1-2H3InChIKey
SMGTYHFNFXTZBB-UHFFFAOYSA-NSynonyms
385421-45-4385421454
CC1=C(C2=CC(=C(C=C2O1)Br)OCC3=CC(=CC=C3)(N+)(=O)(O))C(=O)OC
COC(=O)c1c(C)oc2c1cc(OCc1cccc(c1)(N+)(=O)(O))c(c2)Br
InChI=1SC18H14BrNO6c11017(18(21)242)13716(14(19)815(13)2610)2591143512(611)20(22)23h38H9H212H3
methyl6bromo2methyl5((3nitrobenzyl)oxy)1benzofuran3carboxylate
METHYL6BROMO2METHYL5((3NITROBENZYL)OXY)BENZOFURAN3CARBOXYLATE
METHYL6BROMO2METHYL5((3NITROPHENYL)METHOXY)1BENZOFURAN3CARBOXYLATE
METHYL6BROMO2METHYL5((3NITROPHENYL)METHOXY)BENZO(B)FURAN3CARBOXYLATE
MFCD03146479
ZINC000001155728
ZINC01155728
ZINC1155728
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