2-[2,4-bis(fluoranyl)phenyl]-5,7-dimethyl-quinoline-4-carboxylic acid

Systemtic Name: 2-[2,4-bis(fluoranyl)phenyl]-5,7-dimethyl-quinoline-4-carboxylic acid Openeye Name: 2-(2,4-difluorophenyl)-5,7-dimethyl-quinoline-4-carboxylic acid CAS Name: 2-(2,4-difluorophenyl)-5,7-dimethyl-4-quinolinecarboxylic acid IUPAC Name: 2-(2,4-difluorophenyl)-5,7-dimethylquinoline-4-carboxylic acid Traditional Name: 2-(2,4-difluorophenyl)-5,7-dimethyl-cinchoninic acid Formula: C18H13F2NO2 MolecularWeight: 313.298126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=CC(=NC2=C1)C3=C(C=C(C=C3)F)F)C(=O)O)C

Isomeric SMILES

CC1=CC(=C2C(=CC(=NC2=C1)C3=C(C=C(C=C3)F)F)C(=O)O)C

InChI

InChI=1S/C18H13F2NO2/c1-9-5-10(2)17-13(18(22)23)8-15(21-16(17)6-9)12-4-3-11(19)7-14(12)20/h3-8H,1-2H3,(H,22,23)