2-phenyl-N-[7-[(2-phenylquinolin-4-yl)carbonylamino]heptyl]quinoline-4-carboxamide

Systemtic Name: 2-phenyl-N-[7-[(2-phenylquinolin-4-yl)carbonylamino]heptyl]quinoline-4-carboxamide Openeye Name: 2-phenyl-N-[7-[(2-phenylquinoline-4-carbonyl)amino]heptyl]quinoline-4-carboxamide CAS Name: N-[7-[[oxo-(2-phenyl-4-quinolinyl)methyl]amino]heptyl]-2-phenyl-4-quinolinecarboxamide IUPAC Name: 2-phenyl-N-[7-[(2-phenylquinoline-4-carbonyl)amino]heptyl]quinoline-4-carboxamide Traditional Name: 2-phenyl-N-[7-[(2-phenylquinoline-4-carbonyl)amino]heptyl]cinchoninamide Formula: C39H36N4O2 MolecularWeight: 592.72874

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCCCCCCCNC(=O)C4=CC(=NC5=CC=CC=C54)C6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCCCCCCCNC(=O)C4=CC(=NC5=CC=CC=C54)C6=CC=CC=C6

InChI

InChI=1S/C39H36N4O2/c44-38(32-26-36(28-16-6-4-7-17-28)42-34-22-12-10-20-30(32)34)40-24-14-2-1-3-15-25-41-39(45)33-27-37(29-18-8-5-9-19-29)43-35-23-13-11-21-31(33)35/h4-13,16-23,26-27H,1-3,14-15,24-25H2,(H,40,44)(H,41,45)