2-(3,4-dimethylphenyl)-N-pentyl-quinoline-4-carboxamide

Systemtic Name: 2-(3,4-dimethylphenyl)-N-pentyl-quinoline-4-carboxamide Openeye Name: 2-(3,4-dimethylphenyl)-N-pentyl-quinoline-4-carboxamide CAS Name: 2-(3,4-dimethylphenyl)-N-pentyl-4-quinolinecarboxamide IUPAC Name: 2-(3,4-dimethylphenyl)-N-pentylquinoline-4-carboxamide Traditional Name: N-amyl-2-(3,4-dimethylphenyl)cinchoninamide Formula: C23H26N2O MolecularWeight: 346.46534

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC(=C(C=C3)C)C

Isomeric SMILES

CCCCCNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC(=C(C=C3)C)C

InChI

InChI=1S/C23H26N2O/c1-4-5-8-13-24-23(26)20-15-22(18-12-11-16(2)17(3)14-18)25-21-10-7-6-9-19(20)21/h6-7,9-12,14-15H,4-5,8,13H2,1-3H3,(H,24,26)