N-[2-(cyclohexen-1-yl)ethyl]-2-[(4-propan-2-ylphenyl)amino]quinoline-4-carboxamide

Systemtic Name: N-[2-(cyclohexen-1-yl)ethyl]-2-[(4-propan-2-ylphenyl)amino]quinoline-4-carboxamide Openeye Name: N-[2-(cyclohexen-1-yl)ethyl]-2-(4-isopropylanilino)quinoline-4-carboxamide CAS Name: N-[2-(1-cyclohexenyl)ethyl]-2-(4-propan-2-ylanilino)-4-quinolinecarboxamide IUPAC Name: N-[2-(cyclohexen-1-yl)ethyl]-2-(4-propan-2-ylanilino)quinoline-4-carboxamide Traditional Name: 2-cumidino-N-[2-(cyclohexen-1-yl)ethyl]cinchoninamide Formula: C27H31N3O MolecularWeight: 413.55454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC2=NC3=CC=CC=C3C(=C2)C(=O)NCCC4=CCCCC4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC2=NC3=CC=CC=C3C(=C2)C(=O)NCCC4=CCCCC4

InChI

InChI=1S/C27H31N3O/c1-19(2)21-12-14-22(15-13-21)29-26-18-24(23-10-6-7-11-25(23)30-26)27(31)28-17-16-20-8-4-3-5-9-20/h6-8,10-15,18-19H,3-5,9,16-17H2,1-2H3,(H,28,31)(H,29,30)