6-fluoranyl-N-(3-methylbutyl)-2-phenyl-quinoline-4-carboxamide

Systemtic Name: 6-fluoranyl-N-(3-methylbutyl)-2-phenyl-quinoline-4-carboxamide Openeye Name: 6-fluoro-N-isopentyl-2-phenyl-quinoline-4-carboxamide CAS Name: 6-fluoro-N-(3-methylbutyl)-2-phenyl-4-quinolinecarboxamide IUPAC Name: 6-fluoro-N-(3-methylbutyl)-2-phenylquinoline-4-carboxamide Traditional Name: 6-fluoro-N-isoamyl-2-phenyl-cinchoninamide Formula: C21H21FN2O MolecularWeight: 336.402643

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=CC(=NC2=C1C=C(C=C2)F)C3=CC=CC=C3

Isomeric SMILES

CC(C)CCNC(=O)C1=CC(=NC2=C1C=C(C=C2)F)C3=CC=CC=C3

InChI

InChI=1S/C21H21FN2O/c1-14(2)10-11-23-21(25)18-13-20(15-6-4-3-5-7-15)24-19-9-8-16(22)12-17(18)19/h3-9,12-14H,10-11H2,1-2H3,(H,23,25)