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

Systemtic Name: 2-(4-bromophenyl)-N-(3-methylbutyl)quinoline-4-carboxamide Openeye Name: 2-(4-bromophenyl)-N-isopentyl-quinoline-4-carboxamide CAS Name: 2-(4-bromophenyl)-N-(3-methylbutyl)-4-quinolinecarboxamide IUPAC Name: 2-(4-bromophenyl)-N-(3-methylbutyl)quinoline-4-carboxamide Traditional Name: 2-(4-bromophenyl)-N-isoamyl-cinchoninamide Formula: C21H21BrN2O MolecularWeight: 397.30824

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)Br

Isomeric SMILES

CC(C)CCNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H21BrN2O/c1-14(2)11-12-23-21(25)18-13-20(15-7-9-16(22)10-8-15)24-19-6-4-3-5-17(18)19/h3-10,13-14H,11-12H2,1-2H3,(H,23,25)