diethyl 2-[[[3-(2,6-dimethylpyridin-4-yl)-4-fluoranyl-phenyl]amino]methylidene]propanedioate

Systemtic Name: diethyl 2-[[[3-(2,6-dimethylpyridin-4-yl)-4-fluoranyl-phenyl]amino]methylidene]propanedioate Openeye Name: diethyl 2-[[3-(2,6-dimethyl-4-pyridyl)-4-fluoro-anilino]methylene]propanedioate CAS Name: 2-[[3-(2,6-dimethyl-4-pyridinyl)-4-fluoroanilino]methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[3-(2,6-dimethylpyridin-4-yl)-4-fluoroanilino]methylidene]propanedioate Traditional Name: 2-[[3-(2,6-dimethyl-4-pyridyl)-4-fluoro-anilino]methylene]malonic acid diethyl ester Formula: C21H23FN2O4 MolecularWeight: 386.416723

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=CC(=C(C=C1)F)C2=CC(=NC(=C2)C)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=CNC1=CC(=C(C=C1)F)C2=CC(=NC(=C2)C)C)C(=O)OCC

InChI

InChI=1S/C21H23FN2O4/c1-5-27-20(25)18(21(26)28-6-2)12-23-16-7-8-19(22)17(11-16)15-9-13(3)24-14(4)10-15/h7-12,23H,5-6H2,1-4H3