6-bromanyl-2-(4-propan-2-ylphenyl)-N-propyl-quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-2-(4-propan-2-ylphenyl)-N-propyl-quinoline-4-carboxamide Openeye Name: 6-bromo-2-(4-isopropylphenyl)-N-propyl-quinoline-4-carboxamide CAS Name: 6-bromo-2-(4-propan-2-ylphenyl)-N-propyl-4-quinolinecarboxamide IUPAC Name: 6-bromo-2-(4-propan-2-ylphenyl)-N-propylquinoline-4-carboxamide Traditional Name: 6-bromo-2-p-cumenyl-N-propyl-cinchoninamide Formula: C22H23BrN2O MolecularWeight: 411.33482

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC(=NC2=C1C=C(C=C2)Br)C3=CC=C(C=C3)C(C)C

Isomeric SMILES

CCCNC(=O)C1=CC(=NC2=C1C=C(C=C2)Br)C3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C22H23BrN2O/c1-4-11-24-22(26)19-13-21(16-7-5-15(6-8-16)14(2)3)25-20-10-9-17(23)12-18(19)20/h5-10,12-14H,4,11H2,1-3H3,(H,24,26)