7-(5-azanyl-1,3-dihydroisoindol-2-yl)-1-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(5-azanyl-1,3-dihydroisoindol-2-yl)-1-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(5-aminoisoindolin-2-yl)-1-ethyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(5-amino-1,3-dihydroisoindol-2-yl)-1-ethyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(5-amino-1,3-dihydroisoindol-2-yl)-1-ethyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(5-aminoisoindolin-2-yl)-1-ethyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C20H18FN3O3 MolecularWeight: 367.373623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CC4=C(C3)C=C(C=C4)N)F)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CC4=C(C3)C=C(C=C4)N)F)C(=O)O

InChI

InChI=1S/C20H18FN3O3/c1-2-23-10-15(20(26)27)19(25)14-6-16(21)18(7-17(14)23)24-8-11-3-4-13(22)5-12(11)9-24/h3-7,10H,2,8-9,22H2,1H3,(H,26,27)