6-bromanyl-8-methyl-N-(oxolan-2-ylmethyl)-2-phenyl-quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-8-methyl-N-(oxolan-2-ylmethyl)-2-phenyl-quinoline-4-carboxamide Openeye Name: 6-bromo-8-methyl-2-phenyl-N-(tetrahydrofuran-2-ylmethyl)quinoline-4-carboxamide CAS Name: 6-bromo-8-methyl-N-(2-oxolanylmethyl)-2-phenyl-4-quinolinecarboxamide IUPAC Name: 6-bromo-8-methyl-N-(oxolan-2-ylmethyl)-2-phenylquinoline-4-carboxamide Traditional Name: 6-bromo-8-methyl-2-phenyl-N-(tetrahydrofurfuryl)cinchoninamide Formula: C22H21BrN2O2 MolecularWeight: 425.31834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)Br)C(=CC(=N2)C3=CC=CC=C3)C(=O)NCC4CCCO4

Isomeric SMILES

CC1=C2C(=CC(=C1)Br)C(=CC(=N2)C3=CC=CC=C3)C(=O)NCC4CCCO4

InChI

InChI=1S/C22H21BrN2O2/c1-14-10-16(23)11-18-19(22(26)24-13-17-8-5-9-27-17)12-20(25-21(14)18)15-6-3-2-4-7-15/h2-4,6-7,10-12,17H,5,8-9,13H2,1H3,(H,24,26)