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

Systemtic Name: 7-(3,5-dimethylpiperazin-1-yl)-6-fluoranyl-1-(3-methylbut-2-enyl)-4-oxidanylidene-2-phenyl-quinoline-3-carboxylic acid Openeye Name: 7-(3,5-dimethylpiperazin-1-yl)-6-fluoro-1-(3-methylbut-2-enyl)-4-oxo-2-phenyl-quinoline-3-carboxylic acid CAS Name: 7-(3,5-dimethyl-1-piperazinyl)-6-fluoro-1-(3-methylbut-2-enyl)-4-oxo-2-phenyl-3-quinolinecarboxylic acid IUPAC Name: 7-(3,5-dimethylpiperazin-1-yl)-6-fluoro-1-(3-methylbut-2-enyl)-4-oxo-2-phenylquinoline-3-carboxylic acid Traditional Name: 7-(3,5-dimethylpiperazino)-6-fluoro-4-keto-1-(3-methylbut-2-enyl)-2-phenyl-quinoline-3-carboxylic acid Formula: C27H30FN3O3 MolecularWeight: 463.543803

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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)C4=CC=CC=C4)CC=C(C)C)F

Isomeric SMILES

CC1CN(CC(N1)C)C2=C(C=C3C(=C2)N(C(=C(C3=O)C(=O)O)C4=CC=CC=C4)CC=C(C)C)F

InChI

InChI=1S/C27H30FN3O3/c1-16(2)10-11-31-22-13-23(30-14-17(3)29-18(4)15-30)21(28)12-20(22)26(32)24(27(33)34)25(31)19-8-6-5-7-9-19/h5-10,12-13,17-18,29H,11,14-15H2,1-4H3,(H,33,34)