2-(3,4-dimethylphenyl)-6-fluoranyl-N-phenethyl-quinoline-4-carboxamide

Systemtic Name: 2-(3,4-dimethylphenyl)-6-fluoranyl-N-phenethyl-quinoline-4-carboxamide Openeye Name: 2-(3,4-dimethylphenyl)-6-fluoro-N-phenethyl-quinoline-4-carboxamide CAS Name: 2-(3,4-dimethylphenyl)-6-fluoro-N-phenethyl-4-quinolinecarboxamide IUPAC Name: 2-(3,4-dimethylphenyl)-6-fluoro-N-phenethylquinoline-4-carboxamide Traditional Name: 2-(3,4-dimethylphenyl)-6-fluoro-N-phenethyl-cinchoninamide Formula: C26H23FN2O MolecularWeight: 398.472023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=C(C=C(C=C3)F)C(=C2)C(=O)NCCC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=C(C=C(C=C3)F)C(=C2)C(=O)NCCC4=CC=CC=C4)C

InChI

InChI=1S/C26H23FN2O/c1-17-8-9-20(14-18(17)2)25-16-23(22-15-21(27)10-11-24(22)29-25)26(30)28-13-12-19-6-4-3-5-7-19/h3-11,14-16H,12-13H2,1-2H3,(H,28,30)