7-(3,5-dimethylpiperazin-1-yl)-6-fluoranyl-2-methyl-1-(3-methylbut-2-enyl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(3,5-dimethylpiperazin-1-yl)-6-fluoranyl-2-methyl-1-(3-methylbut-2-enyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(3,5-dimethylpiperazin-1-yl)-6-fluoro-2-methyl-1-(3-methylbut-2-enyl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(3,5-dimethyl-1-piperazinyl)-6-fluoro-2-methyl-1-(3-methylbut-2-enyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(3,5-dimethylpiperazin-1-yl)-6-fluoro-2-methyl-1-(3-methylbut-2-enyl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(3,5-dimethylpiperazino)-6-fluoro-4-keto-2-methyl-1-(3-methylbut-2-enyl)quinoline-3-carboxylic acid Formula: C22H28FN3O3 MolecularWeight: 401.474423

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(N1)C)C2=C(C=C3C(=C2)N(C(=C(C3=O)C(=O)O)C)CC=C(C)C)F

Isomeric SMILES

CC1CN(CC(N1)C)C2=C(C=C3C(=C2)N(C(=C(C3=O)C(=O)O)C)CC=C(C)C)F

InChI

InChI=1S/C22H28FN3O3/c1-12(2)6-7-26-15(5)20(22(28)29)21(27)16-8-17(23)19(9-18(16)26)25-10-13(3)24-14(4)11-25/h6,8-9,13-14,24H,7,10-11H2,1-5H3,(H,28,29)