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

Systemtic Name: 7-[4-(1-acetyloxyethoxycarbonyl)piperazin-1-yl]-1-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[4-(1-acetoxyethoxycarbonyl)piperazin-1-yl]-1-ethyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[4-[1-acetyloxyethoxy(oxo)methyl]-1-piperazinyl]-1-ethyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[4-(1-acetyloxyethoxycarbonyl)piperazin-1-yl]-1-ethyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[4-(1-acetoxyethoxycarbonyl)piperazino]-1-ethyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C21H24FN3O7 MolecularWeight: 449.429563

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24FN3O7/c1-4-23-11-15(20(28)29)19(27)14-9-16(22)18(10-17(14)23)24-5-7-25(8-6-24)21(30)32-13(3)31-12(2)26/h9-11,13H,4-8H2,1-3H3,(H,28,29)