Vitas-M small molecule compound
methyl 3-{[4-(ethoxycarbonyl)phenyl]carbamoyl}-5-nitrobenzoate
Catalog ID
STK071028
SMILES CCOC(=O)c1ccc(cc1)NC(=O)c1cc(cc(c1)C(=O)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 C18H16N2O7 MW 372.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N2O7/c1-3-27-18(23)11-4-6-14(7-5-11)19-16(21)12-8-13(17(22)26-2)10-15(9-12)20(24)25/h4-10H,3H2,1-2H3,(H,19,21)InChIKey
MYASFEVJZGISNQ-UHFFFAOYSA-NSynonyms
348605-19-6348605196
CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=CC(=C2)(N+)(=O)(O))C(=O)OC
CCOC(=O)c1ccc(cc1)NC(=O)c1cc(cc(c1)C(=O)OC)(N+)(=O)(O)
InChI=1SC18H16N2O7c132718(23)114614(7511)1916(21)12813(17(22)262)1015(912)20(24)25h410H3H212H3(H1921)
METHYL3((4(ETHOXYCARBONYL)PHENYL)CARBAMOYL)5NITROBENZOATE
METHYL3((4ETHOXYCARBONYLPHENYL)CARBAMOYL)5NITROBENZOATE
METHYL5(N(4(ETHOXYCARBONYL)PHENYL)CARBAMOYL)3NITROBENZOATE
MFCD01196924
STK071028
ZINC000001207177
ZINC01207177
ZINC1207177
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