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

Systemtic Name: 1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-7-[3-[oxidanyl(1,3-thiazol-4-yl)methyl]pyrrolidin-1-yl]quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-7-[3-[hydroxy(thiazol-4-yl)methyl]pyrrolidin-1-yl]-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-7-[3-[hydroxy(4-thiazolyl)methyl]-1-pyrrolidinyl]-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-7-[3-[hydroxy(1,3-thiazol-4-yl)methyl]pyrrolidin-1-yl]-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-7-[3-[hydroxy(thiazol-4-yl)methyl]pyrrolidino]-4-keto-8-methoxy-quinoline-3-carboxylic acid Formula: C22H22FN3O5S MolecularWeight: 459.490583

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1N3CCC(C3)C(C4=CSC=N4)O)F)C(=O)C(=CN2C5CC5)C(=O)O

Isomeric SMILES

COC1=C2C(=CC(=C1N3CCC(C3)C(C4=CSC=N4)O)F)C(=O)C(=CN2C5CC5)C(=O)O

InChI

InChI=1S/C22H22FN3O5S/c1-31-21-17-13(20(28)14(22(29)30)8-26(17)12-2-3-12)6-15(23)18(21)25-5-4-11(7-25)19(27)16-9-32-10-24-16/h6,8-12,19,27H,2-5,7H2,1H3,(H,29,30)