[7-(3-azanylpyrrolidin-1-yl)-8-chloranyl-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinolin-3-yl] hydrogen carbonate; sulfuric acid

Systemtic Name: [7-(3-azanylpyrrolidin-1-yl)-8-chloranyl-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinolin-3-yl] hydrogen carbonate; sulfuric acid Openeye Name: [7-(3-aminopyrrolidin-1-yl)-8-chloro-1-cyclopropyl-6-fluoro-4-oxo-3-quinolyl] hydrogen carbonate; sulfuric acid CAS Name: carbonic acid [7-(3-amino-1-pyrrolidinyl)-8-chloro-1-cyclopropyl-6-fluoro-4-oxo-3-quinolinyl] ester; sulfuric acid IUPAC Name: [7-(3-aminopyrrolidin-1-yl)-8-chloro-1-cyclopropyl-6-fluoro-4-oxoquinolin-3-yl] hydrogen carbonate; sulfuric acid Traditional Name: carbonic acid [7-(3-aminopyrrolidino)-8-chloro-1-cyclopropyl-6-fluoro-4-keto-3-quinolyl] ester; sulfuric acid Formula: C17H19ClFN3O8S MolecularWeight: 479.864463

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=CC(=C(C(=C32)Cl)N4CCC(C4)N)F)OC(=O)O.OS(=O)(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=CC(=C(C(=C32)Cl)N4CCC(C4)N)F)OC(=O)O.OS(=O)(=O)O

InChI

InChI=1S/C17H17ClFN3O4.H2O4S/c18-13-14-10(5-11(19)15(13)21-4-3-8(20)6-21)16(23)12(26-17(24)25)7-22(14)9-1-2-9;1-5(2,3)4/h5,7-9H,1-4,6,20H2,(H,24,25);(H2,1,2,3,4)