diethyl 2-[1-cyclopropyl-6-fluoranyl-7-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-4-oxidanylidene-quinolin-3-yl]carbonylpropanedioate

Systemtic Name: diethyl 2-[1-cyclopropyl-6-fluoranyl-7-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-4-oxidanylidene-quinolin-3-yl]carbonylpropanedioate Openeye Name: diethyl 2-[7-(4-tert-butoxycarbonylpiperazin-1-yl)-1-cyclopropyl-6-fluoro-4-oxo-quinoline-3-carbonyl]propanedioate CAS Name: 2-[[1-cyclopropyl-6-fluoro-7-[4-[(2-methylpropan-2-yl)oxy-oxomethyl]-1-piperazinyl]-4-oxo-3-quinolinyl]-oxomethyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[1-cyclopropyl-6-fluoro-7-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-4-oxoquinoline-3-carbonyl]propanedioate Traditional Name: 2-[7-(4-tert-butoxycarbonylpiperazino)-1-cyclopropyl-6-fluoro-4-keto-quinoline-3-carbonyl]malonic acid diethyl ester Formula: C29H36FN3O8 MolecularWeight: 573.609843

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)C1=CN(C2=CC(=C(C=C2C1=O)F)N3CCN(CC3)C(=O)OC(C)(C)C)C4CC4)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C(=O)C1=CN(C2=CC(=C(C=C2C1=O)F)N3CCN(CC3)C(=O)OC(C)(C)C)C4CC4)C(=O)OCC

InChI

InChI=1S/C29H36FN3O8/c1-6-39-26(36)23(27(37)40-7-2)25(35)19-16-33(17-8-9-17)21-15-22(20(30)14-18(21)24(19)34)31-10-12-32(13-11-31)28(38)41-29(3,4)5/h14-17,23H,6-13H2,1-5H3