2-[2,5-bis(fluoranyl)phenyl]-7,8-dimethyl-quinoline-4-carboxylic acid

Systemtic Name: 2-[2,5-bis(fluoranyl)phenyl]-7,8-dimethyl-quinoline-4-carboxylic acid Openeye Name: 2-(2,5-difluorophenyl)-7,8-dimethyl-quinoline-4-carboxylic acid CAS Name: 2-(2,5-difluorophenyl)-7,8-dimethyl-4-quinolinecarboxylic acid IUPAC Name: 2-(2,5-difluorophenyl)-7,8-dimethylquinoline-4-carboxylic acid Traditional Name: 2-(2,5-difluorophenyl)-7,8-dimethyl-cinchoninic acid Formula: C18H13F2NO2 MolecularWeight: 313.298126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=N2)C3=C(C=CC(=C3)F)F)C(=O)O)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=N2)C3=C(C=CC(=C3)F)F)C(=O)O)C

InChI

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