7-fluoranyl-8-iodanyl-3-oxidanyl-2-phenyl-N-[(1S)-1-phenylpropyl]quinoline-4-carboxamide

Systemtic Name: 7-fluoranyl-8-iodanyl-3-oxidanyl-2-phenyl-N-[(1S)-1-phenylpropyl]quinoline-4-carboxamide Openeye Name: 7-fluoro-3-hydroxy-8-iodo-2-phenyl-N-[(1S)-1-phenylpropyl]quinoline-4-carboxamide CAS Name: 7-fluoro-3-hydroxy-8-iodo-2-phenyl-N-[(1S)-1-phenylpropyl]-4-quinolinecarboxamide IUPAC Name: 7-fluoro-3-hydroxy-8-iodo-2-phenyl-N-[(1S)-1-phenylpropyl]quinoline-4-carboxamide Traditional Name: 7-fluoro-3-hydroxy-8-iodo-2-phenyl-N-[(1S)-1-phenylpropyl]cinchoninamide Formula: C25H20FIN2O2 MolecularWeight: 526.341373

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)NC(=O)C2=C3C=CC(=C(C3=NC(=C2O)C4=CC=CC=C4)I)F

Isomeric SMILES

CC[C@@H](C1=CC=CC=C1)NC(=O)C2=C3C=CC(=C(C3=NC(=C2O)C4=CC=CC=C4)I)F

InChI

InChI=1S/C25H20FIN2O2/c1-2-19(15-9-5-3-6-10-15)28-25(31)20-17-13-14-18(26)21(27)23(17)29-22(24(20)30)16-11-7-4-8-12-16/h3-14,19,30H,2H2,1H3,(H,28,31)/t19-/m0/s1