methyl 1-(3-fluorophenyl)-2-methyl-1-(2-oxidanylidene-1,3-oxazolidin-5-yl)octane-1-sulfonate

Systemtic Name: methyl 1-(3-fluorophenyl)-2-methyl-1-(2-oxidanylidene-1,3-oxazolidin-5-yl)octane-1-sulfonate Openeye Name: methyl 1-(3-fluorophenyl)-2-methyl-1-(2-oxooxazolidin-5-yl)octane-1-sulfonate CAS Name: 1-(3-fluorophenyl)-2-methyl-1-(2-oxo-5-oxazolidinyl)-1-octanesulfonic acid IUPAC Name: methyl 1-(3-fluorophenyl)-2-methyl-1-(2-oxo-1,3-oxazolidin-5-yl)octane-1-sulfonate Traditional Name: 1-(3-fluorophenyl)-1-(2-ketooxazolidin-5-yl)-2-methyl-octane-1-sulfonic acid methyl ester Formula: C19H28FNO5S MolecularWeight: 401.492723

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)C(C1CNC(=O)O1)(C2=CC(=CC=C2)F)S(=O)(=O)OC

Isomeric SMILES

CCCCCCC(C)C(C1CNC(=O)O1)(C2=CC(=CC=C2)F)S(=O)(=O)OC

InChI

InChI=1S/C19H28FNO5S/c1-4-5-6-7-9-14(2)19(27(23,24)25-3,17-13-21-18(22)26-17)15-10-8-11-16(20)12-15/h8,10-12,14,17H,4-7,9,13H2,1-3H3,(H,21,22)