2-[(2,5-dimethoxyphenyl)amino]-N-[(4-fluorophenyl)methyl]quinoline-4-carboxamide

Systemtic Name: 2-[(2,5-dimethoxyphenyl)amino]-N-[(4-fluorophenyl)methyl]quinoline-4-carboxamide Openeye Name: 2-(2,5-dimethoxyanilino)-N-[(4-fluorophenyl)methyl]quinoline-4-carboxamide CAS Name: 2-(2,5-dimethoxyanilino)-N-[(4-fluorophenyl)methyl]-4-quinolinecarboxamide IUPAC Name: 2-(2,5-dimethoxyanilino)-N-[(4-fluorophenyl)methyl]quinoline-4-carboxamide Traditional Name: 2-(2,5-dimethoxyanilino)-N-(4-fluorobenzyl)cinchoninamide Formula: C25H22FN3O3 MolecularWeight: 431.458883

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CC=C(C=C4)F

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C25H22FN3O3/c1-31-18-11-12-23(32-2)22(13-18)29-24-14-20(19-5-3-4-6-21(19)28-24)25(30)27-15-16-7-9-17(26)10-8-16/h3-14H,15H2,1-2H3,(H,27,30)(H,28,29)