Vitas-M small molecule compound
2-methoxyethyl 2-methyl-5-{[(4-nitrophenyl)carbonyl]oxy}-1-benzofuran-3-carboxylate
Catalog ID
STK836706
SMILES COCCOC(=O)c1c(C)oc2c1cc(cc2)OC(=O)c1ccc(cc1)[N+](=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 C20H17NO8 MW 399.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17NO8/c1-12-18(20(23)27-10-9-26-2)16-11-15(7-8-17(16)28-12)29-19(22)13-3-5-14(6-4-13)21(24)25/h3-8,11H,9-10H2,1-2H3InChIKey
YGYNGVVKYLIIFS-UHFFFAOYSA-NSynonyms
300834-49-52methoxyethyl2methyl5(((4nitrophenyl)carbonyl)oxy)1benzofuran3carboxylate
2METHOXYETHYL2METHYL5((4NITROBENZOYL)OXY)1BENZOFURAN3CARBOXYLATE
2METHOXYETHYL2METHYL5((4NITROBENZOYL)OXY)BENZOFURAN3CARBOXYLATE
2METHOXYETHYL2METHYL5(4NITROBENZOYL)OXY1BENZOFURAN3CARBOXYLATE
3((2METHOXYETHYL)OXYCARBONYL)2METHYLBENZO(B)FURAN5YL4NITROBENZOATE
300834495
CC1=C(C2=C(O1)C=CC(=C2)OC(=O)C3=CC=C(C=C3)(N+)(=O)(O))C(=O)OCCOC
COCCOC(=O)c1c(C)oc2c1cc(cc2)OC(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC20H17NO8c11218(20(23)27109262)161115(7817(16)2812)2919(22)133514(6413)21(24)25h3811H910H212H3
MFCD01551533
ZINC000001787849
ZINC01787849
ZINC1787849
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