N-[(3-fluorophenyl)methyl]-2-[4-(propanoylamino)phenyl]quinoline-4-carboxamide

Systemtic Name: N-[(3-fluorophenyl)methyl]-2-[4-(propanoylamino)phenyl]quinoline-4-carboxamide Openeye Name: N-[(3-fluorophenyl)methyl]-2-[4-(propanoylamino)phenyl]quinoline-4-carboxamide CAS Name: N-[(3-fluorophenyl)methyl]-2-[4-(1-oxopropylamino)phenyl]-4-quinolinecarboxamide IUPAC Name: N-[(3-fluorophenyl)methyl]-2-[4-(propanoylamino)phenyl]quinoline-4-carboxamide Traditional Name: N-(3-fluorobenzyl)-2-(4-propionamidophenyl)cinchoninamide Formula: C26H22FN3O2 MolecularWeight: 427.470183

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CC(=CC=C4)F

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CC(=CC=C4)F

InChI

InChI=1S/C26H22FN3O2/c1-2-25(31)29-20-12-10-18(11-13-20)24-15-22(21-8-3-4-9-23(21)30-24)26(32)28-16-17-6-5-7-19(27)14-17/h3-15H,2,16H2,1H3,(H,28,32)(H,29,31)