1-tert-butyl-6-fluoranyl-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylic acid hydrochloride

Systemtic Name: 1-tert-butyl-6-fluoranyl-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylic acid hydrochloride Openeye Name: 1-tert-butyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-quinoline-3-carboxylic acid hydrochloride CAS Name: 1-tert-butyl-6-fluoro-7-(4-methyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylic acid hydrochloride IUPAC Name: 1-tert-butyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid hydrochloride Traditional Name: 1-tert-butyl-6-fluoro-4-keto-7-(4-methylpiperazino)quinoline-3-carboxylic acid hydrochloride Formula: C19H25ClFN3O3 MolecularWeight: 397.871503

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C)F)C(=O)O.Cl

Isomeric SMILES

CC(C)(C)N1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C)F)C(=O)O.Cl

InChI

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