2-(3,4-dimethylphenyl)-N-[(4-fluorophenyl)methyl]-6-methyl-quinoline-4-carboxamide

Systemtic Name: 2-(3,4-dimethylphenyl)-N-[(4-fluorophenyl)methyl]-6-methyl-quinoline-4-carboxamide Openeye Name: 2-(3,4-dimethylphenyl)-N-[(4-fluorophenyl)methyl]-6-methyl-quinoline-4-carboxamide CAS Name: 2-(3,4-dimethylphenyl)-N-[(4-fluorophenyl)methyl]-6-methyl-4-quinolinecarboxamide IUPAC Name: 2-(3,4-dimethylphenyl)-N-[(4-fluorophenyl)methyl]-6-methylquinoline-4-carboxamide Traditional Name: 2-(3,4-dimethylphenyl)-N-(4-fluorobenzyl)-6-methyl-cinchoninamide Formula: C26H23FN2O MolecularWeight: 398.472023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)NCC3=CC=C(C=C3)F)C4=CC(=C(C=C4)C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)NCC3=CC=C(C=C3)F)C4=CC(=C(C=C4)C)C

InChI

InChI=1S/C26H23FN2O/c1-16-4-11-24-22(12-16)23(26(30)28-15-19-6-9-21(27)10-7-19)14-25(29-24)20-8-5-17(2)18(3)13-20/h4-14H,15H2,1-3H3,(H,28,30)