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

Systemtic Name: 6-bromanyl-2-(4-methylphenyl)-N-phenethyl-quinoline-4-carboxamide Openeye Name: 6-bromo-N-phenethyl-2-(p-tolyl)quinoline-4-carboxamide CAS Name: 6-bromo-2-(4-methylphenyl)-N-phenethyl-4-quinolinecarboxamide IUPAC Name: 6-bromo-2-(4-methylphenyl)-N-phenethylquinoline-4-carboxamide Traditional Name: 6-bromo-N-phenethyl-2-(p-tolyl)cinchoninamide Formula: C25H21BrN2O MolecularWeight: 445.35104

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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)NCCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C25H21BrN2O/c1-17-7-9-19(10-8-17)24-16-22(21-15-20(26)11-12-23(21)28-24)25(29)27-14-13-18-5-3-2-4-6-18/h2-12,15-16H,13-14H2,1H3,(H,27,29)