N-[(4-chlorophenyl)methyl]-8-fluoranyl-1-methyl-4-oxidanylidene-6-[(E)-3-oxidanylprop-1-enyl]quinoline-3-carboxamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-8-fluoranyl-1-methyl-4-oxidanylidene-6-[(E)-3-oxidanylprop-1-enyl]quinoline-3-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-8-fluoro-6-[(E)-3-hydroxyprop-1-enyl]-1-methyl-4-oxo-quinoline-3-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-8-fluoro-6-[(E)-3-hydroxyprop-1-enyl]-1-methyl-4-oxo-3-quinolinecarboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-8-fluoro-6-[(E)-3-hydroxyprop-1-enyl]-1-methyl-4-oxoquinoline-3-carboxamide Traditional Name: N-(4-chlorobenzyl)-8-fluoro-6-[(E)-3-hydroxyprop-1-enyl]-4-keto-1-methyl-quinoline-3-carboxamide Formula: C21H18ClFN2O3 MolecularWeight: 400.830623

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=O)C2=CC(=CC(=C21)F)C=CCO)C(=O)NCC3=CC=C(C=C3)Cl

Isomeric SMILES

CN1C=C(C(=O)C2=CC(=CC(=C21)F)/C=C/CO)C(=O)NCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H18ClFN2O3/c1-25-12-17(21(28)24-11-13-4-6-15(22)7-5-13)20(27)16-9-14(3-2-8-26)10-18(23)19(16)25/h2-7,9-10,12,26H,8,11H2,1H3,(H,24,28)/b3-2+