6-fluoranyl-1-(2-fluoranylethyl)-8-methoxy-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 6-fluoranyl-1-(2-fluoranylethyl)-8-methoxy-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 6-fluoro-1-(2-fluoroethyl)-8-methoxy-7-(4-methylpiperazin-1-yl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 6-fluoro-1-(2-fluoroethyl)-8-methoxy-7-(4-methyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 6-fluoro-1-(2-fluoroethyl)-8-methoxy-7-(4-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 6-fluoro-1-(2-fluoroethyl)-4-keto-8-methoxy-7-(4-methylpiperazino)quinoline-3-carboxylic acid Formula: C18H21F2N3O4 MolecularWeight: 381.373846

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C3C(=C2OC)N(C=C(C3=O)C(=O)O)CCF)F

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C3C(=C2OC)N(C=C(C3=O)C(=O)O)CCF)F

InChI

InChI=1S/C18H21F2N3O4/c1-21-5-7-22(8-6-21)15-13(20)9-11-14(17(15)27-2)23(4-3-19)10-12(16(11)24)18(25)26/h9-10H,3-8H2,1-2H3,(H,25,26)