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

Systemtic Name: N-[(4-chlorophenyl)methyl]-8-fluoranyl-6-(3-methoxybut-1-ynyl)-4-oxidanylidene-1H-quinoline-3-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-8-fluoro-6-(3-methoxybut-1-ynyl)-4-oxo-1H-quinoline-3-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-8-fluoro-6-(3-methoxybut-1-ynyl)-4-oxo-1H-quinoline-3-carboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-8-fluoro-6-(3-methoxybut-1-ynyl)-4-oxo-1H-quinoline-3-carboxamide Traditional Name: N-(4-chlorobenzyl)-8-fluoro-4-keto-6-(3-methoxybut-1-ynyl)-1H-quinoline-3-carboxamide Formula: C22H18ClFN2O3 MolecularWeight: 412.841323

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#CC1=CC2=C(C(=C1)F)NC=C(C2=O)C(=O)NCC3=CC=C(C=C3)Cl)OC

Isomeric SMILES

CC(C#CC1=CC2=C(C(=C1)F)NC=C(C2=O)C(=O)NCC3=CC=C(C=C3)Cl)OC

InChI

InChI=1S/C22H18ClFN2O3/c1-13(29-2)3-4-15-9-17-20(19(24)10-15)25-12-18(21(17)27)22(28)26-11-14-5-7-16(23)8-6-14/h5-10,12-13H,11H2,1-2H3,(H,25,27)(H,26,28)