Vitas-M small molecule compound
methyl 3-[(4-chloro-2,5-dimethoxyphenyl)carbamoyl]-5-nitrobenzoate
Catalog ID
STK008774
SMILES COc1cc(Cl)c(cc1NC(=O)c1cc(cc(c1)C(=O)OC)[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 C17H15ClN2O7 MW 394.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15ClN2O7/c1-25-14-8-13(15(26-2)7-12(14)18)19-16(21)9-4-10(17(22)27-3)6-11(5-9)20(23)24/h4-8H,1-3H3,(H,19,21)InChIKey
RXPZDKIVMRPBQJ-UHFFFAOYSA-NSynonyms
329931-81-9329931819
COC1=CC(=C(C=C1NC(=O)C2=CC(=CC(=C2)(N+)(=O)(O))C(=O)OC)OC)Cl
COc1cc(Cl)c(cc1NC(=O)c1cc(cc(c1)C(=O)OC)(N+)(=O)(O))OC
InChI=1SC17H15ClN2O7c12514813(15(262)712(14)18)1916(21)9410(17(22)273)611(59)20(23)24h48H13H3(H1921)
METHYL3((4CHLORO25DIMETHOXYPHENYL)CARBAMOYL)5NITROBENZOATE
METHYL5(N(4CHLORO25DIMETHOXYPHENYL)CARBAMOYL)3NITROBENZOATE
MFCD01196904
STK008774
ZINC000001097970
ZINC01097970
ZINC1097970
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