6-bromanyl-2-(4-butylphenyl)-N-[2-(3-chlorophenyl)ethyl]quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-2-(4-butylphenyl)-N-[2-(3-chlorophenyl)ethyl]quinoline-4-carboxamide Openeye Name: 6-bromo-2-(4-butylphenyl)-N-[2-(3-chlorophenyl)ethyl]quinoline-4-carboxamide CAS Name: 6-bromo-2-(4-butylphenyl)-N-[2-(3-chlorophenyl)ethyl]-4-quinolinecarboxamide IUPAC Name: 6-bromo-2-(4-butylphenyl)-N-[2-(3-chlorophenyl)ethyl]quinoline-4-carboxamide Traditional Name: 6-bromo-2-(4-butylphenyl)-N-[2-(3-chlorophenyl)ethyl]cinchoninamide Formula: C28H26BrClN2O MolecularWeight: 521.87584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NCCC4=CC(=CC=C4)Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NCCC4=CC(=CC=C4)Cl

InChI

InChI=1S/C28H26BrClN2O/c1-2-3-5-19-8-10-21(11-9-19)27-18-25(24-17-22(29)12-13-26(24)32-27)28(33)31-15-14-20-6-4-7-23(30)16-20/h4,6-13,16-18H,2-3,5,14-15H2,1H3,(H,31,33)