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

Systemtic Name: 1-cyclopropyl-6-fluoranyl-8-methoxy-7-[3-methyl-1-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrolidin-1-ium-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[1-(tert-butoxycarbonylamino)-3-methyl-pyrrolidin-1-ium-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-1-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-pyrrolidin-1-iumyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-8-methoxy-7-[3-methyl-1-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrolidin-1-ium-1-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[1-(tert-butoxycarbonylamino)-3-methyl-pyrrolidin-1-ium-1-yl]-1-cyclopropyl-6-fluoro-4-keto-8-methoxy-quinoline-3-carboxylic acid Formula: C24H31FN3O6+ MolecularWeight: 476.517843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC[N+](C1)(C2=C(C=C3C(=C2OC)N(C=C(C3=O)C(=O)O)C4CC4)F)NC(=O)OC(C)(C)C

Isomeric SMILES

CC1CC[N+](C1)(C2=C(C=C3C(=C2OC)N(C=C(C3=O)C(=O)O)C4CC4)F)NC(=O)OC(C)(C)C

InChI

InChI=1S/C24H30FN3O6/c1-13-8-9-28(12-13,26-23(32)34-24(2,3)4)19-17(25)10-15-18(21(19)33-5)27(14-6-7-14)11-16(20(15)29)22(30)31/h10-11,13-14H,6-9,12H2,1-5H3,(H-,26,30,31,32)/p+1