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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20FN3O3/c1-3-4-22-11-13(18(24)25)17(23)12-9-14(19)16(10-15(12)22)21-7-5-20(2)6-8-21/h3,9-11H,1,4-8H2,2H3,(H,24,25)