8-chloranyl-1-cyclopropyl-2-fluoranyl-4-oxidanylidene-7-piperazin-1-yl-quinoline-3-carboxylic acid

Systemtic Name: 8-chloranyl-1-cyclopropyl-2-fluoranyl-4-oxidanylidene-7-piperazin-1-yl-quinoline-3-carboxylic acid Openeye Name: 8-chloro-1-cyclopropyl-2-fluoro-4-oxo-7-piperazin-1-yl-quinoline-3-carboxylic acid CAS Name: 8-chloro-1-cyclopropyl-2-fluoro-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic acid IUPAC Name: 8-chloro-1-cyclopropyl-2-fluoro-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid Traditional Name: 8-chloro-1-cyclopropyl-2-fluoro-4-keto-7-piperazino-quinoline-3-carboxylic acid Formula: C17H17ClFN3O3 MolecularWeight: 365.786583

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C3=C(C=CC(=C3Cl)N4CCNCC4)C(=O)C(=C2F)C(=O)O

Isomeric SMILES

C1CC1N2C3=C(C=CC(=C3Cl)N4CCNCC4)C(=O)C(=C2F)C(=O)O

InChI

InChI=1S/C17H17ClFN3O3/c18-13-11(21-7-5-20-6-8-21)4-3-10-14(13)22(9-1-2-9)16(19)12(15(10)23)17(24)25/h3-4,9,20H,1-2,5-8H2,(H,24,25)