6-bromanyl-2-(4-ethylphenyl)-N-propyl-quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-2-(4-ethylphenyl)-N-propyl-quinoline-4-carboxamide Openeye Name: 6-bromo-2-(4-ethylphenyl)-N-propyl-quinoline-4-carboxamide CAS Name: 6-bromo-2-(4-ethylphenyl)-N-propyl-4-quinolinecarboxamide IUPAC Name: 6-bromo-2-(4-ethylphenyl)-N-propylquinoline-4-carboxamide Traditional Name: 6-bromo-2-(4-ethylphenyl)-N-propyl-cinchoninamide Formula: C21H21BrN2O MolecularWeight: 397.30824

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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)CC

Isomeric SMILES

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

InChI

InChI=1S/C21H21BrN2O/c1-3-11-23-21(25)18-13-20(15-7-5-14(4-2)6-8-15)24-19-10-9-16(22)12-17(18)19/h5-10,12-13H,3-4,11H2,1-2H3,(H,23,25)