6-fluoranyl-3-methyl-2-[4-(2-methylphenyl)-2,3-dihydroindol-1-yl]quinoline-4-carboxylic acid

Systemtic Name: 6-fluoranyl-3-methyl-2-[4-(2-methylphenyl)-2,3-dihydroindol-1-yl]quinoline-4-carboxylic acid Openeye Name: 6-fluoro-3-methyl-2-[4-(o-tolyl)indolin-1-yl]quinoline-4-carboxylic acid CAS Name: 6-fluoro-3-methyl-2-[4-(2-methylphenyl)-2,3-dihydroindol-1-yl]-4-quinolinecarboxylic acid IUPAC Name: 6-fluoro-3-methyl-2-[4-(2-methylphenyl)-2,3-dihydroindol-1-yl]quinoline-4-carboxylic acid Traditional Name: 6-fluoro-3-methyl-2-[4-(o-tolyl)indolin-1-yl]cinchoninic acid Formula: C26H21FN2O2 MolecularWeight: 412.455543

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C3CCN(C3=CC=C2)C4=C(C(=C5C=C(C=CC5=N4)F)C(=O)O)C

Isomeric SMILES

CC1=CC=CC=C1C2=C3CCN(C3=CC=C2)C4=C(C(=C5C=C(C=CC5=N4)F)C(=O)O)C

InChI

InChI=1S/C26H21FN2O2/c1-15-6-3-4-7-18(15)19-8-5-9-23-20(19)12-13-29(23)25-16(2)24(26(30)31)21-14-17(27)10-11-22(21)28-25/h3-11,14H,12-13H2,1-2H3,(H,30,31)