1-ethyl-6-fluoranyl-7-[[2-(2-hydroxyphenyl)-4-oxidanylidene-1,3-thiazolidin-3-yl]amino]-4-oxidanylidene-3H-quinolin-1-ium-3-carboxylic acid

Systemtic Name: 1-ethyl-6-fluoranyl-7-[[2-(2-hydroxyphenyl)-4-oxidanylidene-1,3-thiazolidin-3-yl]amino]-4-oxidanylidene-3H-quinolin-1-ium-3-carboxylic acid Openeye Name: 1-ethyl-6-fluoro-7-[[2-(2-hydroxyphenyl)-4-oxo-thiazolidin-3-yl]amino]-4-oxo-3H-quinolin-1-ium-3-carboxylic acid CAS Name: 1-ethyl-6-fluoro-7-[[2-(2-hydroxyphenyl)-4-oxo-3-thiazolidinyl]amino]-4-oxo-3H-quinolin-1-ium-3-carboxylic acid IUPAC Name: 1-ethyl-6-fluoro-7-[[2-(2-hydroxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]amino]-4-oxo-3H-quinolin-1-ium-3-carboxylic acid Traditional Name: 1-ethyl-6-fluoro-7-[[2-(2-hydroxyphenyl)-4-keto-thiazolidin-3-yl]amino]-4-keto-3H-quinolin-1-ium-3-carboxylic acid Formula: C21H19FN3O5S+ MolecularWeight: 444.456063

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=CC(C(=O)C2=CC(=C(C=C21)NN3C(SCC3=O)C4=CC=CC=C4O)F)C(=O)O

Isomeric SMILES

CC[N+]1=CC(C(=O)C2=CC(=C(C=C21)NN3C(SCC3=O)C4=CC=CC=C4O)F)C(=O)O

InChI

InChI=1S/C21H18FN3O5S/c1-2-24-9-13(21(29)30)19(28)12-7-14(22)15(8-16(12)24)23-25-18(27)10-31-20(25)11-5-3-4-6-17(11)26/h3-9,13,20H,2,10H2,1H3,(H2-,23,26,28,29,30)/p+1