1-cyclopropyl-5-diazanyl-6,8-bis(fluoranyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanylidene-2-pyrrolidin-1-yl-2H-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-5-diazanyl-6,8-bis(fluoranyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanylidene-2-pyrrolidin-1-yl-2H-quinoline-3-carboxylic acid Openeye Name: 3-(tert-butoxycarbonylamino)-1-cyclopropyl-6,8-difluoro-5-hydrazino-4-oxo-2-pyrrolidin-1-yl-2H-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6,8-difluoro-5-hydrazinyl-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-oxo-2-(1-pyrrolidinyl)-2H-quinoline-3-carboxylic acid IUPAC Name: 1-cyclopropyl-6,8-difluoro-5-hydrazinyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxo-2-pyrrolidin-1-yl-2H-quinoline-3-carboxylic acid Traditional Name: 3-(tert-butoxycarbonylamino)-1-cyclopropyl-6,8-difluoro-5-hydrazino-4-keto-2-pyrrolidino-2H-quinoline-3-carboxylic acid Formula: C22H29F2N5O5 MolecularWeight: 481.492966

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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=C2F)F)NN)C3CC3)N4CCCC4)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC1(C(N(C2=C(C1=O)C(=C(C=C2F)F)NN)C3CC3)N4CCCC4)C(=O)O

InChI

InChI=1S/C22H29F2N5O5/c1-21(2,3)34-20(33)26-22(19(31)32)17(30)14-15(27-25)12(23)10-13(24)16(14)29(11-6-7-11)18(22)28-8-4-5-9-28/h10-11,18,27H,4-9,25H2,1-3H3,(H,26,33)(H,31,32)