5,6,8-tris(fluoranyl)-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-1-propan-2-yl-quinoline-3-carboxylic acid

Systemtic Name: 5,6,8-tris(fluoranyl)-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-1-propan-2-yl-quinoline-3-carboxylic acid Openeye Name: 5,6,8-trifluoro-1-isopropyl-7-(4-methylpiperazin-1-yl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 5,6,8-trifluoro-7-(4-methyl-1-piperazinyl)-4-oxo-1-propan-2-yl-3-quinolinecarboxylic acid IUPAC Name: 5,6,8-trifluoro-7-(4-methylpiperazin-1-yl)-4-oxo-1-propan-2-ylquinoline-3-carboxylic acid Traditional Name: 5,6,8-trifluoro-1-isopropyl-4-keto-7-(4-methylpiperazino)quinoline-3-carboxylic acid Formula: C18H20F3N3O3 MolecularWeight: 383.36491

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=C(C(=O)C2=C1C(=C(C(=C2F)F)N3CCN(CC3)C)F)C(=O)O

Isomeric SMILES

CC(C)N1C=C(C(=O)C2=C1C(=C(C(=C2F)F)N3CCN(CC3)C)F)C(=O)O

InChI

InChI=1S/C18H20F3N3O3/c1-9(2)24-8-10(18(26)27)17(25)11-12(19)13(20)16(14(21)15(11)24)23-6-4-22(3)5-7-23/h8-9H,4-7H2,1-3H3,(H,26,27)