7-[4-[[2-(aminocarbonyloxymethyl)-4-oxidanylidene-1-sulfo-azetidin-3-yl]iminomethyl]piperazin-1-yl]-1-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[4-[[2-(aminocarbonyloxymethyl)-4-oxidanylidene-1-sulfo-azetidin-3-yl]iminomethyl]piperazin-1-yl]-1-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[4-[[2-(carbamoyloxymethyl)-4-oxo-1-sulfo-azetidin-3-yl]iminomethyl]piperazin-1-yl]-1-ethyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[4-[[2-(carbamoyloxymethyl)-4-oxo-1-sulfo-3-azetidinyl]iminomethyl]-1-piperazinyl]-1-ethyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[4-[[2-(carbamoyloxymethyl)-4-oxo-1-sulfoazetidin-3-yl]iminomethyl]piperazin-1-yl]-1-ethyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[4-[[2-(carbamoyloxymethyl)-4-keto-1-sulfo-azetidin-3-yl]iminomethyl]piperazino]-1-ethyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C22H25FN6O9S MolecularWeight: 568.532103

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C=NC4C(N(C4=O)S(=O)(=O)O)COC(=O)N)F)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C=NC4C(N(C4=O)S(=O)(=O)O)COC(=O)N)F)C(=O)O

InChI

InChI=1S/C22H25FN6O9S/c1-2-27-9-13(21(32)33)19(30)12-7-14(23)16(8-15(12)27)28-5-3-26(4-6-28)11-25-18-17(10-38-22(24)34)29(20(18)31)39(35,36)37/h7-9,11,17-18H,2-6,10H2,1H3,(H2,24,34)(H,32,33)(H,35,36,37)