methyl 2-[[1-[(3-fluorophenyl)methyl]-6-oxidanylidene-pyridin-3-yl]carbonyl-methyl-amino]benzoate

Systemtic Name: methyl 2-[[1-[(3-fluorophenyl)methyl]-6-oxidanylidene-pyridin-3-yl]carbonyl-methyl-amino]benzoate Openeye Name: methyl 2-[[1-[(3-fluorophenyl)methyl]-6-oxo-pyridine-3-carbonyl]-methyl-amino]benzoate CAS Name: 2-[[[1-[(3-fluorophenyl)methyl]-6-oxo-3-pyridinyl]-oxomethyl]-methylamino]benzoic acid methyl ester IUPAC Name: methyl 2-[[1-[(3-fluorophenyl)methyl]-6-oxopyridine-3-carbonyl]-methylamino]benzoate Traditional Name: 2-[[1-(3-fluorobenzyl)-6-keto-nicotinoyl]-methyl-amino]benzoic acid methyl ester Formula: C22H19FN2O4 MolecularWeight: 394.395663

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1C(=O)OC)C(=O)C2=CN(C(=O)C=C2)CC3=CC(=CC=C3)F

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)OC)C(=O)C2=CN(C(=O)C=C2)CC3=CC(=CC=C3)F

InChI

InChI=1S/C22H19FN2O4/c1-24(19-9-4-3-8-18(19)22(28)29-2)21(27)16-10-11-20(26)25(14-16)13-15-6-5-7-17(23)12-15/h3-12,14H,13H2,1-2H3