methyl 4-[[1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-6-oxidanylidene-pyridin-3-yl]carbonylamino]benzoate

Systemtic Name: methyl 4-[[1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-6-oxidanylidene-pyridin-3-yl]carbonylamino]benzoate Openeye Name: methyl 4-[[1-[(2-chloro-6-fluoro-phenyl)methyl]-6-oxo-pyridine-3-carbonyl]amino]benzoate CAS Name: 4-[[[1-[(2-chloro-6-fluorophenyl)methyl]-6-oxo-3-pyridinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[1-[(2-chloro-6-fluorophenyl)methyl]-6-oxopyridine-3-carbonyl]amino]benzoate Traditional Name: 4-[[1-(2-chloro-6-fluoro-benzyl)-6-keto-nicotinoyl]amino]benzoic acid methyl ester Formula: C21H16ClFN2O4 MolecularWeight: 414.814143

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)C2=CN(C(=O)C=C2)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)C2=CN(C(=O)C=C2)CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C21H16ClFN2O4/c1-29-21(28)13-5-8-15(9-6-13)24-20(27)14-7-10-19(26)25(11-14)12-16-17(22)3-2-4-18(16)23/h2-11H,12H2,1H3,(H,24,27)