2-(2-fluorophenyl)-N-[(3S)-2-oxidanylideneazepan-3-yl]quinoline-4-carboxamide

Systemtic Name: 2-(2-fluorophenyl)-N-[(3S)-2-oxidanylideneazepan-3-yl]quinoline-4-carboxamide Openeye Name: 2-(2-fluorophenyl)-N-[(3S)-2-oxoazepan-3-yl]quinoline-4-carboxamide CAS Name: 2-(2-fluorophenyl)-N-[(3S)-2-oxo-3-azepanyl]-4-quinolinecarboxamide IUPAC Name: 2-(2-fluorophenyl)-N-[(3S)-2-oxoazepan-3-yl]quinoline-4-carboxamide Traditional Name: 2-(2-fluorophenyl)-N-[(3S)-2-ketoazepan-3-yl]cinchoninamide Formula: C22H20FN3O2 MolecularWeight: 377.411503

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4F

Isomeric SMILES

C1CCNC(=O)[C@H](C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4F

InChI

InChI=1S/C22H20FN3O2/c23-17-9-3-1-8-15(17)20-13-16(14-7-2-4-10-18(14)25-20)21(27)26-19-11-5-6-12-24-22(19)28/h1-4,7-10,13,19H,5-6,11-12H2,(H,24,28)(H,26,27)/t19-/m0/s1