6-chloranyl-2-(2,4-dimethylphenyl)-8-fluoranyl-quinoline-4-carboxylic acid

Systemtic Name: 6-chloranyl-2-(2,4-dimethylphenyl)-8-fluoranyl-quinoline-4-carboxylic acid Openeye Name: 6-chloro-2-(2,4-dimethylphenyl)-8-fluoro-quinoline-4-carboxylic acid CAS Name: 6-chloro-2-(2,4-dimethylphenyl)-8-fluoro-4-quinolinecarboxylic acid IUPAC Name: 6-chloro-2-(2,4-dimethylphenyl)-8-fluoroquinoline-4-carboxylic acid Traditional Name: 6-chloro-2-(2,4-dimethylphenyl)-8-fluoro-cinchoninic acid Formula: C18H13ClFNO2 MolecularWeight: 329.752723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=NC3=C(C=C(C=C3C(=C2)C(=O)O)Cl)F)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=NC3=C(C=C(C=C3C(=C2)C(=O)O)Cl)F)C

InChI

InChI=1S/C18H13ClFNO2/c1-9-3-4-12(10(2)5-9)16-8-14(18(22)23)13-6-11(19)7-15(20)17(13)21-16/h3-8H,1-2H3,(H,22,23)