[4-[(3-carboxyoxy-6-fluoranyl-1-methyl-4-oxidanylidene-quinolin-7-yl)amino]-1-phosphono-butyl]phosphonic acid

Systemtic Name: [4-[(3-carboxyoxy-6-fluoranyl-1-methyl-4-oxidanylidene-quinolin-7-yl)amino]-1-phosphono-butyl]phosphonic acid Openeye Name: [4-[(3-carboxyoxy-6-fluoro-1-methyl-4-oxo-7-quinolyl)amino]-1-phosphono-butyl]phosphonic acid CAS Name: [4-[(3-carboxyoxy-6-fluoro-1-methyl-4-oxo-7-quinolinyl)amino]-1-phosphonobutyl]phosphonic acid IUPAC Name: [4-[(3-carboxyoxy-6-fluoro-1-methyl-4-oxoquinolin-7-yl)amino]-1-phosphonobutyl]phosphonic acid Traditional Name: [4-[(3-carboxyoxy-6-fluoro-4-keto-1-methyl-7-quinolyl)amino]-1-phosphono-butyl]phosphonic acid Formula: C15H19FN2O10P2 MolecularWeight: 468.264685

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=O)C2=CC(=C(C=C21)NCCCC(P(=O)(O)O)P(=O)(O)O)F)OC(=O)O

Isomeric SMILES

CN1C=C(C(=O)C2=CC(=C(C=C21)NCCCC(P(=O)(O)O)P(=O)(O)O)F)OC(=O)O

InChI

InChI=1S/C15H19FN2O10P2/c1-18-7-12(28-15(20)21)14(19)8-5-9(16)10(6-11(8)18)17-4-2-3-13(29(22,23)24)30(25,26)27/h5-7,13,17H,2-4H2,1H3,(H,20,21)(H2,22,23,24)(H2,25,26,27)