5-fluoranyl-4-(4-fluorophenyl)-2-methyl-1-oxidanylidene-isoquinoline-3-carboxylic acid

Systemtic Name: 5-fluoranyl-4-(4-fluorophenyl)-2-methyl-1-oxidanylidene-isoquinoline-3-carboxylic acid Openeye Name: 5-fluoro-4-(4-fluorophenyl)-2-methyl-1-oxo-isoquinoline-3-carboxylic acid CAS Name: 5-fluoro-4-(4-fluorophenyl)-2-methyl-1-oxo-3-isoquinolinecarboxylic acid IUPAC Name: 5-fluoro-4-(4-fluorophenyl)-2-methyl-1-oxoisoquinoline-3-carboxylic acid Traditional Name: 5-fluoro-4-(4-fluorophenyl)-1-keto-2-methyl-isoquinoline-3-carboxylic acid Formula: C17H11F2NO3 MolecularWeight: 315.270946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C2=C(C1=O)C=CC=C2F)C3=CC=C(C=C3)F)C(=O)O

Isomeric SMILES

CN1C(=C(C2=C(C1=O)C=CC=C2F)C3=CC=C(C=C3)F)C(=O)O

InChI

InChI=1S/C17H11F2NO3/c1-20-15(17(22)23)13(9-5-7-10(18)8-6-9)14-11(16(20)21)3-2-4-12(14)19/h2-8H,1H3,(H,22,23)