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

Systemtic Name: 6-fluoranyl-7-iodanyl-3-oxidanyl-2-phenyl-N-[(1S)-1-phenylpropyl]quinoline-4-carboxamide Openeye Name: 6-fluoro-3-hydroxy-7-iodo-2-phenyl-N-[(1S)-1-phenylpropyl]quinoline-4-carboxamide CAS Name: 6-fluoro-3-hydroxy-7-iodo-2-phenyl-N-[(1S)-1-phenylpropyl]-4-quinolinecarboxamide IUPAC Name: 6-fluoro-3-hydroxy-7-iodo-2-phenyl-N-[(1S)-1-phenylpropyl]quinoline-4-carboxamide Traditional Name: 6-fluoro-3-hydroxy-7-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=C(C(=NC3=CC(=C(C=C32)F)I)C4=CC=CC=C4)O

Isomeric SMILES

CC[C@@H](C1=CC=CC=C1)NC(=O)C2=C(C(=NC3=CC(=C(C=C32)F)I)C4=CC=CC=C4)O

InChI

InChI=1S/C25H20FIN2O2/c1-2-20(15-9-5-3-6-10-15)29-25(31)22-17-13-18(26)19(27)14-21(17)28-23(24(22)30)16-11-7-4-8-12-16/h3-14,20,30H,2H2,1H3,(H,29,31)/t20-/m0/s1