N-[(4-chlorophenyl)methyl]-8-fluoranyl-4-oxidanylidene-2-(2-pyridin-2-ylethynyl)-1H-quinoline-3-carboxamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-8-fluoranyl-4-oxidanylidene-2-(2-pyridin-2-ylethynyl)-1H-quinoline-3-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-8-fluoro-4-oxo-2-[2-(2-pyridyl)ethynyl]-1H-quinoline-3-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-8-fluoro-4-oxo-2-[2-(2-pyridinyl)ethynyl]-1H-quinoline-3-carboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-8-fluoro-4-oxo-2-(2-pyridin-2-ylethynyl)-1H-quinoline-3-carboxamide Traditional Name: N-(4-chlorobenzyl)-8-fluoro-4-keto-2-[2-(2-pyridyl)ethynyl]-1H-quinoline-3-carboxamide Formula: C24H15ClFN3O2 MolecularWeight: 431.846203

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C#CC2=C(C(=O)C3=C(N2)C(=CC=C3)F)C(=O)NCC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=NC(=C1)C#CC2=C(C(=O)C3=C(N2)C(=CC=C3)F)C(=O)NCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H15ClFN3O2/c25-16-9-7-15(8-10-16)14-28-24(31)21-20(12-11-17-4-1-2-13-27-17)29-22-18(23(21)30)5-3-6-19(22)26/h1-10,13H,14H2,(H,28,31)(H,29,30)