2-(4-bromophenyl)-N-(2-cyanoethyl)-N-phenyl-quinoline-4-carboxamide

Systemtic Name: 2-(4-bromophenyl)-N-(2-cyanoethyl)-N-phenyl-quinoline-4-carboxamide Openeye Name: 2-(4-bromophenyl)-N-(2-cyanoethyl)-N-phenyl-quinoline-4-carboxamide CAS Name: 2-(4-bromophenyl)-N-(2-cyanoethyl)-N-phenyl-4-quinolinecarboxamide IUPAC Name: 2-(4-bromophenyl)-N-(2-cyanoethyl)-N-phenylquinoline-4-carboxamide Traditional Name: 2-(4-bromophenyl)-N-(2-cyanoethyl)-N-phenyl-cinchoninamide Formula: C25H18BrN3O MolecularWeight: 456.33392

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CCC#N)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)N(CCC#N)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Br

InChI

InChI=1S/C25H18BrN3O/c26-19-13-11-18(12-14-19)24-17-22(21-9-4-5-10-23(21)28-24)25(30)29(16-6-15-27)20-7-2-1-3-8-20/h1-5,7-14,17H,6,16H2