[3-[4-(3-carboxyoxy-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinolin-7-yl)piperazin-1-yl]-1-phosphono-propyl]phosphonic acid

Systemtic Name: [3-[4-(3-carboxyoxy-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinolin-7-yl)piperazin-1-yl]-1-phosphono-propyl]phosphonic acid Openeye Name: [3-[4-(3-carboxyoxy-1-cyclopropyl-6-fluoro-4-oxo-7-quinolyl)piperazin-1-yl]-1-phosphono-propyl]phosphonic acid CAS Name: [3-[4-(3-carboxyoxy-1-cyclopropyl-6-fluoro-4-oxo-7-quinolinyl)-1-piperazinyl]-1-phosphonopropyl]phosphonic acid IUPAC Name: [3-[4-(3-carboxyoxy-1-cyclopropyl-6-fluoro-4-oxoquinolin-7-yl)piperazin-1-yl]-1-phosphonopropyl]phosphonic acid Traditional Name: [3-[4-(3-carboxyoxy-1-cyclopropyl-6-fluoro-4-keto-7-quinolyl)piperazino]-1-phosphono-propyl]phosphonic acid Formula: C20H26FN3O10P2 MolecularWeight: 549.380465

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCN(CC4)CCC(P(=O)(O)O)P(=O)(O)O)F)OC(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCN(CC4)CCC(P(=O)(O)O)P(=O)(O)O)F)OC(=O)O

InChI

InChI=1S/C20H26FN3O10P2/c21-14-9-13-15(24(12-1-2-12)11-17(19(13)25)34-20(26)27)10-16(14)23-7-5-22(6-8-23)4-3-18(35(28,29)30)36(31,32)33/h9-12,18H,1-8H2,(H,26,27)(H2,28,29,30)(H2,31,32,33)