2-cyclopropyl-N-[(4-dimethylaminophenyl)methyl]-N-(oxolan-2-ylmethyl)quinoline-4-carboxamide

Systemtic Name: 2-cyclopropyl-N-[(4-dimethylaminophenyl)methyl]-N-(oxolan-2-ylmethyl)quinoline-4-carboxamide Openeye Name: 2-cyclopropyl-N-[(4-dimethylaminophenyl)methyl]-N-(tetrahydrofuran-2-ylmethyl)quinoline-4-carboxamide CAS Name: 2-cyclopropyl-N-[(4-dimethylaminophenyl)methyl]-N-(2-oxolanylmethyl)-4-quinolinecarboxamide IUPAC Name: 2-cyclopropyl-N-[(4-dimethylaminophenyl)methyl]-N-(oxolan-2-ylmethyl)quinoline-4-carboxamide Traditional Name: 2-cyclopropyl-N-[4-(dimethylamino)benzyl]-N-(tetrahydrofurfuryl)cinchoninamide Formula: C27H31N3O2 MolecularWeight: 429.55394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CN(CC2CCCO2)C(=O)C3=CC(=NC4=CC=CC=C43)C5CC5

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CN(CC2CCCO2)C(=O)C3=CC(=NC4=CC=CC=C43)C5CC5

InChI

InChI=1S/C27H31N3O2/c1-29(2)21-13-9-19(10-14-21)17-30(18-22-6-5-15-32-22)27(31)24-16-26(20-11-12-20)28-25-8-4-3-7-23(24)25/h3-4,7-10,13-14,16,20,22H,5-6,11-12,15,17-18H2,1-2H3