7-[4-(2-ethoxy-2-oxidanylidene-ethyl)piperazin-1-yl]-1-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[4-(2-ethoxy-2-oxidanylidene-ethyl)piperazin-1-yl]-1-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[4-(2-ethoxy-2-oxo-ethyl)piperazin-1-yl]-1-ethyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[4-(2-ethoxy-2-oxoethyl)-1-piperazinyl]-1-ethyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[4-(2-ethoxy-2-oxoethyl)piperazin-1-yl]-1-ethyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[4-(2-ethoxy-2-keto-ethyl)piperazino]-1-ethyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C20H24FN3O5 MolecularWeight: 405.420063

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)CC(=O)OCC)F)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)CC(=O)OCC)F)C(=O)O

InChI

InChI=1S/C20H24FN3O5/c1-3-23-11-14(20(27)28)19(26)13-9-15(21)17(10-16(13)23)24-7-5-22(6-8-24)12-18(25)29-4-2/h9-11H,3-8,12H2,1-2H3,(H,27,28)