Vitas-M small molecule compound

methyl 2-{[(4,5-dimethoxy-2-nitrophenyl)carbonyl]amino}benzoate

Catalog ID
STK066490
SMILES COC(=O)c1ccccc1NC(=O)c1cc(OC)c(cc1[N+](=O)[O-])OC

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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/c1-24-14-8-11(13(19(22)23)9-15(14)25-2)16(20)18-12-7-5-4-6-10(12)17(21)26-3/h4-9H,1-3H3,(H,18,20)
InChIKey
PTSXPURLSYCTRR-UHFFFAOYSA-N
Synonyms
349399-60-6
349399606
COC(=O)c1ccccc1NC(=O)c1cc(OC)c(cc1(N+)(=O)(O))OC
COC1=C(C=C(C(=C1)C(=O)NC2=CC=CC=C2C(=O)OC)(N+)(=O)(O))OC
InChI=1SC17H16N2O7c12414811(13(19(22)23)915(14)252)16(20)1812754610(12)17(21)263h49H13H3(H1820)
METHYL2(((45DIMETHOXY2NITROPHENYL)CARBONYL)AMINO)BENZOATE
METHYL2((45DIMETHOXY2NITROBENZOYL)AMINO)BENZOATE
METHYL2((45DIMETHOXY2NITROPHENYL)CARBONYLAMINO)BENZOATE
MFCD02211323
STK066490
ZINC000001191791
ZINC01191791
ZINC1191791

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.