7-(3,3-dimethyl-4-oxidanyl-piperidin-1-yl)-1,8-diethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(3,3-dimethyl-4-oxidanyl-piperidin-1-yl)-1,8-diethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1,8-diethyl-6-fluoro-7-(4-hydroxy-3,3-dimethyl-1-piperidyl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 1,8-diethyl-6-fluoro-7-(4-hydroxy-3,3-dimethyl-1-piperidinyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1,8-diethyl-6-fluoro-7-(4-hydroxy-3,3-dimethylpiperidin-1-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 1,8-diethyl-6-fluoro-7-(4-hydroxy-3,3-dimethyl-piperidino)-4-keto-quinoline-3-carboxylic acid Formula: C21H27FN2O4 MolecularWeight: 390.448483

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC(=C1N3CCC(C(C3)(C)C)O)F)C(=O)C(=CN2CC)C(=O)O

Isomeric SMILES

CCC1=C2C(=CC(=C1N3CCC(C(C3)(C)C)O)F)C(=O)C(=CN2CC)C(=O)O

InChI

InChI=1S/C21H27FN2O4/c1-5-12-17-13(19(26)14(20(27)28)10-23(17)6-2)9-15(22)18(12)24-8-7-16(25)21(3,4)11-24/h9-10,16,25H,5-8,11H2,1-4H3,(H,27,28)