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

Systemtic Name: 6-fluoranyl-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-1-prop-1-en-2-yl-quinoline-3-carboxylic acid Openeye Name: 6-fluoro-1-isopropenyl-7-(4-methylpiperazin-1-yl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 6-fluoro-1-(1-methylethenyl)-7-(4-methyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-1-prop-1-en-2-ylquinoline-3-carboxylic acid Traditional Name: 6-fluoro-1-isopropenyl-4-keto-7-(4-methylpiperazino)quinoline-3-carboxylic acid Formula: C18H20FN3O3 MolecularWeight: 345.368103

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)N1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C)F)C(=O)O

Isomeric SMILES

CC(=C)N1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C)F)C(=O)O

InChI

InChI=1S/C18H20FN3O3/c1-11(2)22-10-13(18(24)25)17(23)12-8-14(19)16(9-15(12)22)21-6-4-20(3)5-7-21/h8-10H,1,4-7H2,2-3H3,(H,24,25)