N-[(2S)-2-ethylhexyl]-2-(3-methoxyphenyl)quinoline-4-carboxamide

Systemtic Name: N-[(2S)-2-ethylhexyl]-2-(3-methoxyphenyl)quinoline-4-carboxamide Openeye Name: N-[(2S)-2-ethylhexyl]-2-(3-methoxyphenyl)quinoline-4-carboxamide CAS Name: N-[(2S)-2-ethylhexyl]-2-(3-methoxyphenyl)-4-quinolinecarboxamide IUPAC Name: N-[(2S)-2-ethylhexyl]-2-(3-methoxyphenyl)quinoline-4-carboxamide Traditional Name: N-[(2S)-2-ethylhexyl]-2-(3-methoxyphenyl)cinchoninamide Formula: C25H30N2O2 MolecularWeight: 390.5179

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC(=CC=C3)OC

Isomeric SMILES

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

InChI

InChI=1S/C25H30N2O2/c1-4-6-10-18(5-2)17-26-25(28)22-16-24(19-11-9-12-20(15-19)29-3)27-23-14-8-7-13-21(22)23/h7-9,11-16,18H,4-6,10,17H2,1-3H3,(H,26,28)/t18-/m0/s1