N-butyl-2-(4-fluorophenyl)-N-methyl-quinoline-4-carboxamide

Systemtic Name: N-butyl-2-(4-fluorophenyl)-N-methyl-quinoline-4-carboxamide Openeye Name: N-butyl-2-(4-fluorophenyl)-N-methyl-quinoline-4-carboxamide CAS Name: N-butyl-2-(4-fluorophenyl)-N-methyl-4-quinolinecarboxamide IUPAC Name: N-butyl-2-(4-fluorophenyl)-N-methylquinoline-4-carboxamide Traditional Name: N-butyl-2-(4-fluorophenyl)-N-methyl-cinchoninamide Formula: C21H21FN2O MolecularWeight: 336.402643

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)F

Isomeric SMILES

CCCCN(C)C(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H21FN2O/c1-3-4-13-24(2)21(25)18-14-20(15-9-11-16(22)12-10-15)23-19-8-6-5-7-17(18)19/h5-12,14H,3-4,13H2,1-2H3