Vitas-M small molecule compound
methyl 6-bromo-2-methyl-5-{[(3-nitrophenyl)carbonyl]oxy}-1-benzofuran-3-carboxylate
Catalog ID
STK888033
SMILES COC(=O)c1c(C)oc2c1cc(OC(=O)c1cccc(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 C18H12BrNO7 MW 434.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12BrNO7/c1-9-16(18(22)25-2)12-7-15(13(19)8-14(12)26-9)27-17(21)10-4-3-5-11(6-10)20(23)24/h3-8H,1-2H3InChIKey
LMRLWUCOULJJTN-UHFFFAOYSA-NSynonyms
315237-18-4315237184
6BROMO3(METHOXYCARBONYL)2METHYLBENZO(B)FURAN5YL3NITROBENZOATE
CC1=C(C2=CC(=C(C=C2O1)Br)OC(=O)C3=CC(=CC=C3)(N+)(=O)(O))C(=O)OC
COC(=O)c1c(C)oc2c1cc(OC(=O)c1cccc(c1)(N+)(=O)(O))c(c2)Br
InChI=1SC18H12BrNO7c1916(18(22)252)12715(13(19)814(12)269)2717(21)1043511(610)20(23)24h38H12H3
methyl6bromo2methyl5(((3nitrophenyl)carbonyl)oxy)1benzofuran3carboxylate
METHYL6BROMO2METHYL5((3NITROBENZOYL)OXY)BENZOFURAN3CARBOXYLATE
METHYL6BROMO2METHYL5(3NITROBENZOYL)OXY1BENZOFURAN3CARBOXYLATE
MFCD02167034
ZINC000004531351
ZINC04531351
ZINC4531351
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