N-[(2S)-2-ethylhexyl]-2-naphthalen-1-yl-quinoline-4-carboxamide

Systemtic Name: N-[(2S)-2-ethylhexyl]-2-naphthalen-1-yl-quinoline-4-carboxamide Openeye Name: N-[(2S)-2-ethylhexyl]-2-(1-naphthyl)quinoline-4-carboxamide CAS Name: N-[(2S)-2-ethylhexyl]-2-(1-naphthalenyl)-4-quinolinecarboxamide IUPAC Name: N-[(2S)-2-ethylhexyl]-2-naphthalen-1-ylquinoline-4-carboxamide Traditional Name: N-[(2S)-2-ethylhexyl]-2-(1-naphthyl)cinchoninamide Formula: C28H30N2O MolecularWeight: 410.5506

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCCC[C@H](CC)CNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C28H30N2O/c1-3-5-11-20(4-2)19-29-28(31)25-18-27(30-26-17-9-8-15-24(25)26)23-16-10-13-21-12-6-7-14-22(21)23/h6-10,12-18,20H,3-5,11,19H2,1-2H3,(H,29,31)/t20-/m0/s1