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

Systemtic Name: 2-(3-bromophenyl)-N-heptyl-quinoline-4-carboxamide Openeye Name: 2-(3-bromophenyl)-N-heptyl-quinoline-4-carboxamide CAS Name: 2-(3-bromophenyl)-N-heptyl-4-quinolinecarboxamide IUPAC Name: 2-(3-bromophenyl)-N-heptylquinoline-4-carboxamide Traditional Name: 2-(3-bromophenyl)-N-heptyl-cinchoninamide Formula: C23H25BrN2O MolecularWeight: 425.3614

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25BrN2O/c1-2-3-4-5-8-14-25-23(27)20-16-22(17-10-9-11-18(24)15-17)26-21-13-7-6-12-19(20)21/h6-7,9-13,15-16H,2-5,8,14H2,1H3,(H,25,27)