ethyl 1-ethyl-6,8-bis(fluoranyl)-7-[(3R)-3-methylsulfonyloxypyrrolidin-1-yl]-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 1-ethyl-6,8-bis(fluoranyl)-7-[(3R)-3-methylsulfonyloxypyrrolidin-1-yl]-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 1-ethyl-6,8-difluoro-7-[(3R)-3-methylsulfonyloxypyrrolidin-1-yl]-4-oxo-quinoline-3-carboxylate CAS Name: 1-ethyl-6,8-difluoro-7-[(3R)-3-methylsulfonyloxy-1-pyrrolidinyl]-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-6,8-difluoro-7-[(3R)-3-methylsulfonyloxypyrrolidin-1-yl]-4-oxoquinoline-3-carboxylate Traditional Name: 1-ethyl-6,8-difluoro-4-keto-7-[(3R)-3-methylsulfonyloxypyrrolidino]quinoline-3-carboxylic acid ethyl ester Formula: C19H22F2N2O6S MolecularWeight: 444.449586

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C(=C21)F)N3CCC(C3)OS(=O)(=O)C)F)C(=O)OCC

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C(=C21)F)N3CC[C@H](C3)OS(=O)(=O)C)F)C(=O)OCC

InChI

InChI=1S/C19H22F2N2O6S/c1-4-22-10-13(19(25)28-5-2)18(24)12-8-14(20)17(15(21)16(12)22)23-7-6-11(9-23)29-30(3,26)27/h8,10-11H,4-7,9H2,1-3H3/t11-/m1/s1