1-ethyl-6,8-bis(fluoranyl)-7-(3-methylpiperazin-1-yl)-5-oxidanyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-ethyl-6,8-bis(fluoranyl)-7-(3-methylpiperazin-1-yl)-5-oxidanyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-ethyl-6,8-difluoro-5-hydroxy-7-(3-methylpiperazin-1-yl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-ethyl-6,8-difluoro-5-hydroxy-7-(3-methyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-ethyl-6,8-difluoro-5-hydroxy-7-(3-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-ethyl-6,8-difluoro-5-hydroxy-4-keto-7-(3-methylpiperazino)quinoline-3-carboxylic acid Formula: C17H19F2N3O4 MolecularWeight: 367.347266

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=C1C(=C(C(=C2O)F)N3CCNC(C3)C)F)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=C1C(=C(C(=C2O)F)N3CCNC(C3)C)F)C(=O)O

InChI

InChI=1S/C17H19F2N3O4/c1-3-21-7-9(17(25)26)15(23)10-13(21)11(18)14(12(19)16(10)24)22-5-4-20-8(2)6-22/h7-8,20,24H,3-6H2,1-2H3,(H,25,26)