6-fluoranyl-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-2-phenyl-1H-quinoline-3-carboxylic acid

Systemtic Name: 6-fluoranyl-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-2-phenyl-1H-quinoline-3-carboxylic acid Openeye Name: 6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-2-phenyl-1H-quinoline-3-carboxylic acid CAS Name: 6-fluoro-7-(4-methyl-1-piperazinyl)-4-oxo-2-phenyl-1H-quinoline-3-carboxylic acid IUPAC Name: 6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-2-phenyl-1H-quinoline-3-carboxylic acid Traditional Name: 6-fluoro-4-keto-7-(4-methylpiperazino)-2-phenyl-1H-quinoline-3-carboxylic acid Formula: C21H20FN3O3 MolecularWeight: 381.400203

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C3C(=C2)NC(=C(C3=O)C(=O)O)C4=CC=CC=C4)F

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C3C(=C2)NC(=C(C3=O)C(=O)O)C4=CC=CC=C4)F

InChI

InChI=1S/C21H20FN3O3/c1-24-7-9-25(10-8-24)17-12-16-14(11-15(17)22)20(26)18(21(27)28)19(23-16)13-5-3-2-4-6-13/h2-6,11-12H,7-10H2,1H3,(H,23,26)(H,27,28)