1-cyclopropyl-6-fluoranyl-8-methoxy-7-[3-methyl-3-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]pyrrolidin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6-fluoranyl-8-methoxy-7-[3-methyl-3-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]pyrrolidin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[3-[(tert-butoxycarbonylamino)methyl]-3-methyl-pyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-8-methoxy-7-[3-methyl-3-[[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methyl]-1-pyrrolidinyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-8-methoxy-7-[3-methyl-3-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]pyrrolidin-1-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[3-[(tert-butoxycarbonylamino)methyl]-3-methyl-pyrrolidino]-1-cyclopropyl-6-fluoro-4-keto-8-methoxy-quinoline-3-carboxylic acid Formula: C25H32FN3O6 MolecularWeight: 489.536483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CCN(C1)C2=C(C=C3C(=C2OC)N(C=C(C3=O)C(=O)O)C4CC4)F)CNC(=O)OC(C)(C)C

Isomeric SMILES

CC1(CCN(C1)C2=C(C=C3C(=C2OC)N(C=C(C3=O)C(=O)O)C4CC4)F)CNC(=O)OC(C)(C)C

InChI

InChI=1S/C25H32FN3O6/c1-24(2,3)35-23(33)27-12-25(4)8-9-28(13-25)19-17(26)10-15-18(21(19)34-5)29(14-6-7-14)11-16(20(15)30)22(31)32/h10-11,14H,6-9,12-13H2,1-5H3,(H,27,33)(H,31,32)