4-[[2-fluoranyl-4-(3-oxidanylprop-1-ynyl)phenyl]amino]-1-methyl-6-oxidanylidene-pyridine-3-carboxamide

Systemtic Name: 4-[[2-fluoranyl-4-(3-oxidanylprop-1-ynyl)phenyl]amino]-1-methyl-6-oxidanylidene-pyridine-3-carboxamide Openeye Name: 4-[2-fluoro-4-(3-hydroxyprop-1-ynyl)anilino]-1-methyl-6-oxo-pyridine-3-carboxamide CAS Name: 4-[2-fluoro-4-(3-hydroxyprop-1-ynyl)anilino]-1-methyl-6-oxo-3-pyridinecarboxamide IUPAC Name: 4-[2-fluoro-4-(3-hydroxyprop-1-ynyl)anilino]-1-methyl-6-oxopyridine-3-carboxamide Traditional Name: 4-[2-fluoro-4-(3-hydroxyprop-1-ynyl)anilino]-6-keto-1-methyl-nicotinamide Formula: C16H14FN3O3 MolecularWeight: 315.299063

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=CC1=O)NC2=C(C=C(C=C2)C#CCO)F)C(=O)N

Isomeric SMILES

CN1C=C(C(=CC1=O)NC2=C(C=C(C=C2)C#CCO)F)C(=O)N

InChI

InChI=1S/C16H14FN3O3/c1-20-9-11(16(18)23)14(8-15(20)22)19-13-5-4-10(3-2-6-21)7-12(13)17/h4-5,7-9,19,21H,6H2,1H3,(H2,18,23)