6-fluoranyl-1-(2-methylbutan-2-yl)-4-oxidanylidene-7-piperazin-1-yl-quinoline-3-carboxylic acid

Systemtic Name: 6-fluoranyl-1-(2-methylbutan-2-yl)-4-oxidanylidene-7-piperazin-1-yl-quinoline-3-carboxylic acid Openeye Name: 1-(1,1-dimethylpropyl)-6-fluoro-4-oxo-7-piperazin-1-yl-quinoline-3-carboxylic acid CAS Name: 6-fluoro-1-(2-methylbutan-2-yl)-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic acid IUPAC Name: 6-fluoro-1-(2-methylbutan-2-yl)-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid Traditional Name: 1-tert-amyl-6-fluoro-4-keto-7-piperazino-quinoline-3-carboxylic acid Formula: C19H24FN3O3 MolecularWeight: 361.410563

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)N1C=C(C(=O)C2=CC(=C(C=C21)N3CCNCC3)F)C(=O)O

Isomeric SMILES

CCC(C)(C)N1C=C(C(=O)C2=CC(=C(C=C21)N3CCNCC3)F)C(=O)O

InChI

InChI=1S/C19H24FN3O3/c1-4-19(2,3)23-11-13(18(25)26)17(24)12-9-14(20)16(10-15(12)23)22-7-5-21-6-8-22/h9-11,21H,4-8H2,1-3H3,(H,25,26)