7-(4-azanylcyclohexyl)-8-chloranyl-1-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(4-azanylcyclohexyl)-8-chloranyl-1-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(4-aminocyclohexyl)-8-chloro-1-ethyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(4-aminocyclohexyl)-8-chloro-1-ethyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(4-aminocyclohexyl)-8-chloro-1-ethyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(4-aminocyclohexyl)-8-chloro-1-ethyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C18H20ClFN2O3 MolecularWeight: 366.814403

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C(=C21)Cl)C3CCC(CC3)N)F)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C(=C21)Cl)C3CCC(CC3)N)F)C(=O)O

InChI

InChI=1S/C18H20ClFN2O3/c1-2-22-8-12(18(24)25)17(23)11-7-13(20)14(15(19)16(11)22)9-3-5-10(21)6-4-9/h7-10H,2-6,21H2,1H3,(H,24,25)