tert-butyl 2-[[3-[(4-chlorophenyl)methylcarbamoyl]-8-fluoranyl-4-oxidanylidene-1H-quinolin-6-yl]sulfonylamino]ethanoate

Systemtic Name: tert-butyl 2-[[3-[(4-chlorophenyl)methylcarbamoyl]-8-fluoranyl-4-oxidanylidene-1H-quinolin-6-yl]sulfonylamino]ethanoate Openeye Name: tert-butyl 2-[[3-[(4-chlorophenyl)methylcarbamoyl]-8-fluoro-4-oxo-1H-quinolin-6-yl]sulfonylamino]acetate CAS Name: 2-[[3-[[(4-chlorophenyl)methylamino]-oxomethyl]-8-fluoro-4-oxo-1H-quinolin-6-yl]sulfonylamino]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[3-[(4-chlorophenyl)methylcarbamoyl]-8-fluoro-4-oxo-1H-quinolin-6-yl]sulfonylamino]acetate Traditional Name: 2-[[3-[(4-chlorobenzyl)carbamoyl]-8-fluoro-4-keto-1H-quinolin-6-yl]sulfonylamino]acetic acid tert-butyl ester Formula: C23H23ClFN3O6S MolecularWeight: 523.961623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CNS(=O)(=O)C1=CC(=C2C(=C1)C(=O)C(=CN2)C(=O)NCC3=CC=C(C=C3)Cl)F

Isomeric SMILES

CC(C)(C)OC(=O)CNS(=O)(=O)C1=CC(=C2C(=C1)C(=O)C(=CN2)C(=O)NCC3=CC=C(C=C3)Cl)F

InChI

InChI=1S/C23H23ClFN3O6S/c1-23(2,3)34-19(29)12-28-35(32,33)15-8-16-20(18(25)9-15)26-11-17(21(16)30)22(31)27-10-13-4-6-14(24)7-5-13/h4-9,11,28H,10,12H2,1-3H3,(H,26,30)(H,27,31)