1-ethyl-6-fluoranyl-4-oxidanylidene-7,8-bis(phenylmethoxy)quinoline-3-carboxylic acid

Systemtic Name: 1-ethyl-6-fluoranyl-4-oxidanylidene-7,8-bis(phenylmethoxy)quinoline-3-carboxylic acid Openeye Name: 7,8-dibenzyloxy-1-ethyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-ethyl-6-fluoro-4-oxo-7,8-bis(phenylmethoxy)-3-quinolinecarboxylic acid IUPAC Name: 1-ethyl-6-fluoro-4-oxo-7,8-bis(phenylmethoxy)quinoline-3-carboxylic acid Traditional Name: 7,8-dibenzoxy-1-ethyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C26H22FNO5 MolecularWeight: 447.454983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C(=C21)OCC3=CC=CC=C3)OCC4=CC=CC=C4)F)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C(=C21)OCC3=CC=CC=C3)OCC4=CC=CC=C4)F)C(=O)O

InChI

InChI=1S/C26H22FNO5/c1-2-28-14-20(26(30)31)23(29)19-13-21(27)24(32-15-17-9-5-3-6-10-17)25(22(19)28)33-16-18-11-7-4-8-12-18/h3-14H,2,15-16H2,1H3,(H,30,31)