1-cyclopropyl-6-fluoranyl-5-methyl-7-[3-[1-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]pyrrolidin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6-fluoranyl-5-methyl-7-[3-[1-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]pyrrolidin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[3-[1-(tert-butoxycarbonylamino)ethyl]pyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-5-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-5-methyl-7-[3-[1-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]ethyl]-1-pyrrolidinyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-5-methyl-7-[3-[1-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]pyrrolidin-1-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[3-[1-(tert-butoxycarbonylamino)ethyl]pyrrolidino]-1-cyclopropyl-6-fluoro-4-keto-5-methyl-quinoline-3-carboxylic acid Formula: C25H32FN3O5 MolecularWeight: 473.537083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1F)N3CCC(C3)C(C)NC(=O)OC(C)(C)C)N(C=C(C2=O)C(=O)O)C4CC4

Isomeric SMILES

CC1=C2C(=CC(=C1F)N3CCC(C3)C(C)NC(=O)OC(C)(C)C)N(C=C(C2=O)C(=O)O)C4CC4

InChI

InChI=1S/C25H32FN3O5/c1-13-20-18(29(16-6-7-16)12-17(22(20)30)23(31)32)10-19(21(13)26)28-9-8-15(11-28)14(2)27-24(33)34-25(3,4)5/h10,12,14-16H,6-9,11H2,1-5H3,(H,27,33)(H,31,32)