2-(2-azanylcyclopentyl)sulfanyl-8-chloranyl-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 2-(2-azanylcyclopentyl)sulfanyl-8-chloranyl-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 2-(2-aminocyclopentyl)sulfanyl-8-chloro-1-cyclopropyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 2-[(2-aminocyclopentyl)thio]-8-chloro-1-cyclopropyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 2-(2-aminocyclopentyl)sulfanyl-8-chloro-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 2-[(2-aminocyclopentyl)thio]-8-chloro-1-cyclopropyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C18H18ClFN2O3S MolecularWeight: 396.863523

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(C1)SC2=C(C(=O)C3=CC(=CC(=C3N2C4CC4)Cl)F)C(=O)O)N

Isomeric SMILES

C1CC(C(C1)SC2=C(C(=O)C3=CC(=CC(=C3N2C4CC4)Cl)F)C(=O)O)N

InChI

InChI=1S/C18H18ClFN2O3S/c19-11-7-8(20)6-10-15(11)22(9-4-5-9)17(14(16(10)23)18(24)25)26-13-3-1-2-12(13)21/h6-7,9,12-13H,1-5,21H2,(H,24,25)