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

Systemtic Name: [5-azanyl-1-cyclopropyl-6,8-bis(fluoranyl)-4-oxidanylidene-7-(4-prop-2-enylpiperazin-1-yl)quinolin-3-yl] hydrogen carbonate Openeye Name: [7-(4-allylpiperazin-1-yl)-5-amino-1-cyclopropyl-6,8-difluoro-4-oxo-3-quinolyl] hydrogen carbonate CAS Name: carbonic acid [5-amino-1-cyclopropyl-6,8-difluoro-4-oxo-7-(4-prop-2-enyl-1-piperazinyl)-3-quinolinyl] ester IUPAC Name: [5-amino-1-cyclopropyl-6,8-difluoro-4-oxo-7-(4-prop-2-enylpiperazin-1-yl)quinolin-3-yl] hydrogen carbonate Traditional Name: carbonic acid [7-(4-allylpiperazino)-5-amino-1-cyclopropyl-6,8-difluoro-4-keto-3-quinolyl] ester Formula: C20H22F2N4O4 MolecularWeight: 420.409886

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22F2N4O4/c1-2-5-24-6-8-25(9-7-24)18-14(21)16(23)13-17(15(18)22)26(11-3-4-11)10-12(19(13)27)30-20(28)29/h2,10-11H,1,3-9,23H2,(H,28,29)