7-[3,4-bis(oxidanyl)pyrrolidin-1-yl]-1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[3,4-bis(oxidanyl)pyrrolidin-1-yl]-1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-7-(3,4-dihydroxypyrrolidin-1-yl)-6-fluoro-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-7-(3,4-dihydroxy-1-pyrrolidinyl)-6-fluoro-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-7-(3,4-dihydroxypyrrolidin-1-yl)-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-7-(3,4-dihydroxypyrrolidino)-6-fluoro-4-keto-8-methoxy-quinoline-3-carboxylic acid Formula: C18H19FN2O6 MolecularWeight: 378.351663

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1N3CC(C(C3)O)O)F)C(=O)C(=CN2C4CC4)C(=O)O

Isomeric SMILES

COC1=C2C(=CC(=C1N3CC(C(C3)O)O)F)C(=O)C(=CN2C4CC4)C(=O)O

InChI

InChI=1S/C18H19FN2O6/c1-27-17-14-9(4-11(19)15(17)20-6-12(22)13(23)7-20)16(24)10(18(25)26)5-21(14)8-2-3-8/h4-5,8,12-13,22-23H,2-3,6-7H2,1H3,(H,25,26)