N-(4-butylphenyl)-2-(3-methylphenyl)quinoline-4-carboxamide

Systemtic Name: N-(4-butylphenyl)-2-(3-methylphenyl)quinoline-4-carboxamide Openeye Name: N-(4-butylphenyl)-2-(m-tolyl)quinoline-4-carboxamide CAS Name: N-(4-butylphenyl)-2-(3-methylphenyl)-4-quinolinecarboxamide IUPAC Name: N-(4-butylphenyl)-2-(3-methylphenyl)quinoline-4-carboxamide Traditional Name: N-(4-butylphenyl)-2-(m-tolyl)cinchoninamide Formula: C27H26N2O MolecularWeight: 394.50814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC(=CC=C4)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC(=CC=C4)C

InChI

InChI=1S/C27H26N2O/c1-3-4-9-20-13-15-22(16-14-20)28-27(30)24-18-26(21-10-7-8-19(2)17-21)29-25-12-6-5-11-23(24)25/h5-8,10-18H,3-4,9H2,1-2H3,(H,28,30)