N-(3-fluoranyl-4-methyl-phenyl)-2-morpholin-4-yl-quinoline-4-carboxamide

Systemtic Name: N-(3-fluoranyl-4-methyl-phenyl)-2-morpholin-4-yl-quinoline-4-carboxamide Openeye Name: N-(3-fluoro-4-methyl-phenyl)-2-morpholino-quinoline-4-carboxamide CAS Name: N-(3-fluoro-4-methylphenyl)-2-(4-morpholinyl)-4-quinolinecarboxamide IUPAC Name: N-(3-fluoro-4-methylphenyl)-2-morpholin-4-ylquinoline-4-carboxamide Traditional Name: N-(3-fluoro-4-methyl-phenyl)-2-morpholino-cinchoninamide Formula: C21H20FN3O2 MolecularWeight: 365.400803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)N4CCOCC4)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)N4CCOCC4)F

InChI

InChI=1S/C21H20FN3O2/c1-14-6-7-15(12-18(14)22)23-21(26)17-13-20(25-8-10-27-11-9-25)24-19-5-3-2-4-16(17)19/h2-7,12-13H,8-11H2,1H3,(H,23,26)