1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-7-[3-[oxidanyl(1,3-thiazol-2-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-2-yl)methyl]pyrrolidin-1-yl]quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-7-[3-[hydroxy(thiazol-2-yl)methyl]pyrrolidin-1-yl]-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-7-[3-[hydroxy(2-thiazolyl)methyl]-1-pyrrolidinyl]-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-7-[3-[hydroxy(1,3-thiazol-2-yl)methyl]pyrrolidin-1-yl]-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-7-[3-[hydroxy(thiazol-2-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=NC=CS4)O)F)C(=O)C(=CN2C5CC5)C(=O)O

Isomeric SMILES

COC1=C2C(=CC(=C1N3CCC(C3)C(C4=NC=CS4)O)F)C(=O)C(=CN2C5CC5)C(=O)O

InChI

InChI=1S/C22H22FN3O5S/c1-31-20-16-13(19(28)14(22(29)30)10-26(16)12-2-3-12)8-15(23)17(20)25-6-4-11(9-25)18(27)21-24-5-7-32-21/h5,7-8,10-12,18,27H,2-4,6,9H2,1H3,(H,29,30)