2-(3-bromophenyl)-N-pentyl-quinoline-4-carboxamide

Systemtic Name: 2-(3-bromophenyl)-N-pentyl-quinoline-4-carboxamide Openeye Name: 2-(3-bromophenyl)-N-pentyl-quinoline-4-carboxamide CAS Name: 2-(3-bromophenyl)-N-pentyl-4-quinolinecarboxamide IUPAC Name: 2-(3-bromophenyl)-N-pentylquinoline-4-carboxamide Traditional Name: N-amyl-2-(3-bromophenyl)cinchoninamide Formula: C21H21BrN2O MolecularWeight: 397.30824

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC(=CC=C3)Br

Isomeric SMILES

CCCCCNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC(=CC=C3)Br

InChI

InChI=1S/C21H21BrN2O/c1-2-3-6-12-23-21(25)18-14-20(15-8-7-9-16(22)13-15)24-19-11-5-4-10-17(18)19/h4-5,7-11,13-14H,2-3,6,12H2,1H3,(H,23,25)