Vitas-M small molecule compound

6,7-dimethoxy-3-[(2-methoxy-4-nitrophenyl)amino]-2-benzofuran-1(3H)-one

Catalog ID
STK529435
SMILES COc1cc(ccc1NC1OC(=O)c2c1ccc(c2OC)OC)[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 C17H16N2O7 MW 360.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N2O7/c1-23-12-7-5-10-14(15(12)25-3)17(20)26-16(10)18-11-6-4-9(19(21)22)8-13(11)24-2/h4-8,16,18H,1-3H3
InChIKey
XWIVCJAERNSSLQ-UHFFFAOYSA-N
Synonyms
372088-66-9
372088669
67dimethoxy3((2methoxy4nitrophenyl)amino)2benzofuran1(3H)one
67dimethoxy3((2methoxy4nitrophenyl)amino)isobenzofuran1(3H)one
67DIMETHOXY3(2METHOXY4NITROANILINO)3H2BENZOFURAN1ONE
COC1=C(C2=C(C=C1)C(OC2=O)NC3=C(C=C(C=C3)(N+)(=O)(O))OC)OC
COc1cc(ccc1NC1OC(=O)c2c1ccc(c2OC)OC)(N+)(=O)(O)
InChI=1SC17H16N2O7c12312751014(15(12)253)17(20)2616(10)1811649(19(21)22)813(11)242h481618H13H3
MFCD01877496
ZINC000004794600
ZINC000004794601

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Available files

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