6-bromanyl-2-(4-methylphenyl)-N-(2-methylpropyl)quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-2-(4-methylphenyl)-N-(2-methylpropyl)quinoline-4-carboxamide Openeye Name: 6-bromo-N-isobutyl-2-(p-tolyl)quinoline-4-carboxamide CAS Name: 6-bromo-2-(4-methylphenyl)-N-(2-methylpropyl)-4-quinolinecarboxamide IUPAC Name: 6-bromo-2-(4-methylphenyl)-N-(2-methylpropyl)quinoline-4-carboxamide Traditional Name: 6-bromo-N-isobutyl-2-(p-tolyl)cinchoninamide Formula: C21H21BrN2O MolecularWeight: 397.30824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NCC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NCC(C)C

InChI

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