5-acetamido-1-cyclopropyl-7-(3,5-dimethylpiperazin-1-yl)-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 5-acetamido-1-cyclopropyl-7-(3,5-dimethylpiperazin-1-yl)-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 5-acetamido-1-cyclopropyl-7-(3,5-dimethylpiperazin-1-yl)-6,8-difluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 5-acetamido-1-cyclopropyl-7-(3,5-dimethyl-1-piperazinyl)-6,8-difluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 5-acetamido-1-cyclopropyl-7-(3,5-dimethylpiperazin-1-yl)-6,8-difluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 5-acetamido-1-cyclopropyl-7-(3,5-dimethylpiperazino)-6,8-difluoro-4-keto-quinoline-3-carboxylic acid Formula: C21H24F2N4O4 MolecularWeight: 434.436466

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(N1)C)C2=C(C3=C(C(=C2F)NC(=O)C)C(=O)C(=CN3C4CC4)C(=O)O)F

Isomeric SMILES

CC1CN(CC(N1)C)C2=C(C3=C(C(=C2F)NC(=O)C)C(=O)C(=CN3C4CC4)C(=O)O)F

InChI

InChI=1S/C21H24F2N4O4/c1-9-6-26(7-10(2)24-9)19-15(22)17(25-11(3)28)14-18(16(19)23)27(12-4-5-12)8-13(20(14)29)21(30)31/h8-10,12,24H,4-7H2,1-3H3,(H,25,28)(H,30,31)