2-[(4-chlorophenyl)methyl]-8-fluoranyl-4-oxidanylidene-6-(3-oxidanylprop-1-ynyl)-1H-quinoline-3-carboxamide

Systemtic Name: 2-[(4-chlorophenyl)methyl]-8-fluoranyl-4-oxidanylidene-6-(3-oxidanylprop-1-ynyl)-1H-quinoline-3-carboxamide Openeye Name: 2-[(4-chlorophenyl)methyl]-8-fluoro-6-(3-hydroxyprop-1-ynyl)-4-oxo-1H-quinoline-3-carboxamide CAS Name: 2-[(4-chlorophenyl)methyl]-8-fluoro-6-(3-hydroxyprop-1-ynyl)-4-oxo-1H-quinoline-3-carboxamide IUPAC Name: 2-[(4-chlorophenyl)methyl]-8-fluoro-6-(3-hydroxyprop-1-ynyl)-4-oxo-1H-quinoline-3-carboxamide Traditional Name: 2-(4-chlorobenzyl)-8-fluoro-6-(3-hydroxyprop-1-ynyl)-4-keto-1H-quinoline-3-carboxamide Formula: C20H14ClFN2O3 MolecularWeight: 384.788163

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC2=C(C(=O)C3=C(N2)C(=CC(=C3)C#CCO)F)C(=O)N)Cl

Isomeric SMILES

C1=CC(=CC=C1CC2=C(C(=O)C3=C(N2)C(=CC(=C3)C#CCO)F)C(=O)N)Cl

InChI

InChI=1S/C20H14ClFN2O3/c21-13-5-3-11(4-6-13)10-16-17(20(23)27)19(26)14-8-12(2-1-7-25)9-15(22)18(14)24-16/h3-6,8-9,25H,7,10H2,(H2,23,27)(H,24,26)