6-fluoranyl-1-(1-fluoranylcyclopropyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanylidene-2-pyrrolidin-1-yl-2H-quinoline-3-carboxylic acid

Systemtic Name: 6-fluoranyl-1-(1-fluoranylcyclopropyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanylidene-2-pyrrolidin-1-yl-2H-quinoline-3-carboxylic acid Openeye Name: 3-(tert-butoxycarbonylamino)-6-fluoro-1-(1-fluorocyclopropyl)-4-oxo-2-pyrrolidin-1-yl-2H-quinoline-3-carboxylic acid CAS Name: 6-fluoro-1-(1-fluorocyclopropyl)-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-oxo-2-(1-pyrrolidinyl)-2H-quinoline-3-carboxylic acid IUPAC Name: 6-fluoro-1-(1-fluorocyclopropyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxo-2-pyrrolidin-1-yl-2H-quinoline-3-carboxylic acid Traditional Name: 3-(tert-butoxycarbonylamino)-6-fluoro-1-(1-fluorocyclopropyl)-4-keto-2-pyrrolidino-2H-quinoline-3-carboxylic acid Formula: C22H27F2N3O5 MolecularWeight: 451.463686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1(C(N(C2=C(C1=O)C=C(C=C2)F)C3(CC3)F)N4CCCC4)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC1(C(N(C2=C(C1=O)C=C(C=C2)F)C3(CC3)F)N4CCCC4)C(=O)O

InChI

InChI=1S/C22H27F2N3O5/c1-20(2,3)32-19(31)25-22(18(29)30)16(28)14-12-13(23)6-7-15(14)27(21(24)8-9-21)17(22)26-10-4-5-11-26/h6-7,12,17H,4-5,8-11H2,1-3H3,(H,25,31)(H,29,30)