[1-cyclopropyl-5,6,8-tris(fluoranyl)-4-oxidanylidene-7-(4-prop-2-enylpiperazin-1-yl)quinolin-3-yl] hydrogen carbonate

Systemtic Name: [1-cyclopropyl-5,6,8-tris(fluoranyl)-4-oxidanylidene-7-(4-prop-2-enylpiperazin-1-yl)quinolin-3-yl] hydrogen carbonate Openeye Name: [7-(4-allylpiperazin-1-yl)-1-cyclopropyl-5,6,8-trifluoro-4-oxo-3-quinolyl] hydrogen carbonate CAS Name: carbonic acid [1-cyclopropyl-5,6,8-trifluoro-4-oxo-7-(4-prop-2-enyl-1-piperazinyl)-3-quinolinyl] ester IUPAC Name: [1-cyclopropyl-5,6,8-trifluoro-4-oxo-7-(4-prop-2-enylpiperazin-1-yl)quinolin-3-yl] hydrogen carbonate Traditional Name: carbonic acid [7-(4-allylpiperazino)-1-cyclopropyl-5,6,8-trifluoro-4-keto-3-quinolyl] ester Formula: C20H20F3N3O4 MolecularWeight: 423.38571

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1CCN(CC1)C2=C(C3=C(C(=C2F)F)C(=O)C(=CN3C4CC4)OC(=O)O)F

Isomeric SMILES

C=CCN1CCN(CC1)C2=C(C3=C(C(=C2F)F)C(=O)C(=CN3C4CC4)OC(=O)O)F

InChI

InChI=1S/C20H20F3N3O4/c1-2-5-24-6-8-25(9-7-24)18-15(22)14(21)13-17(16(18)23)26(11-3-4-11)10-12(19(13)27)30-20(28)29/h2,10-11H,1,3-9H2,(H,28,29)