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

Systemtic Name: 8-chloranyl-1-cyclopropyl-6-fluoranyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanylidene-2-pyrrolidin-1-yl-quinoline-3-carboxylic acid Openeye Name: 5-(tert-butoxycarbonylamino)-8-chloro-1-cyclopropyl-6-fluoro-4-oxo-2-pyrrolidin-1-yl-quinoline-3-carboxylic acid CAS Name: 8-chloro-1-cyclopropyl-6-fluoro-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-oxo-2-(1-pyrrolidinyl)-3-quinolinecarboxylic acid IUPAC Name: 8-chloro-1-cyclopropyl-6-fluoro-5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxo-2-pyrrolidin-1-ylquinoline-3-carboxylic acid Traditional Name: 5-(tert-butoxycarbonylamino)-8-chloro-1-cyclopropyl-6-fluoro-4-keto-2-pyrrolidino-quinoline-3-carboxylic acid Formula: C22H25ClFN3O5 MolecularWeight: 465.902403

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=C2C(=C(C=C1F)Cl)N(C(=C(C2=O)C(=O)O)N3CCCC3)C4CC4

Isomeric SMILES

CC(C)(C)OC(=O)NC1=C2C(=C(C=C1F)Cl)N(C(=C(C2=O)C(=O)O)N3CCCC3)C4CC4

InChI

InChI=1S/C22H25ClFN3O5/c1-22(2,3)32-21(31)25-16-13(24)10-12(23)17-14(16)18(28)15(20(29)30)19(26-8-4-5-9-26)27(17)11-6-7-11/h10-11H,4-9H2,1-3H3,(H,25,31)(H,29,30)