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

Systemtic Name: 1-ethyl-6-fluoranyl-7-(3-methylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylic acid hydrochloride Openeye Name: 1-ethyl-6-fluoro-7-(3-methylpiperazin-1-yl)-4-oxo-quinoline-3-carboxylic acid hydrochloride CAS Name: 1-ethyl-6-fluoro-7-(3-methyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylic acid hydrochloride IUPAC Name: 1-ethyl-6-fluoro-7-(3-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid hydrochloride Traditional Name: 1-ethyl-6-fluoro-4-keto-7-(3-methylpiperazino)quinoline-3-carboxylic acid hydrochloride Formula: C17H21ClFN3O3 MolecularWeight: 369.818343

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCNC(C3)C)F)C(=O)O.Cl

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCNC(C3)C)F)C(=O)O.Cl

InChI

InChI=1S/C17H20FN3O3.ClH/c1-3-20-9-12(17(23)24)16(22)11-6-13(18)15(7-14(11)20)21-5-4-19-10(2)8-21;/h6-7,9-10,19H,3-5,8H2,1-2H3,(H,23,24);1H