[3-(4-cyclohexyl-3-fluoranyl-phenyl)-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl 3-nitrobenzenesulfonate

Systemtic Name: [3-(4-cyclohexyl-3-fluoranyl-phenyl)-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl 3-nitrobenzenesulfonate Openeye Name: [3-(4-cyclohexyl-3-fluoro-phenyl)-2-oxo-oxazolidin-5-yl]methyl 3-nitrobenzenesulfonate CAS Name: 3-nitrobenzenesulfonic acid [3-(4-cyclohexyl-3-fluorophenyl)-2-oxo-5-oxazolidinyl]methyl ester IUPAC Name: [3-(4-cyclohexyl-3-fluorophenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl 3-nitrobenzenesulfonate Traditional Name: 3-nitrobenzenesulfonic acid [3-(4-cyclohexyl-3-fluoro-phenyl)-2-keto-oxazolidin-5-yl]methyl ester Formula: C22H23FN2O7S MolecularWeight: 478.490623

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C(C=C(C=C2)N3CC(OC3=O)COS(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-])F

Isomeric SMILES

C1CCC(CC1)C2=C(C=C(C=C2)N3CC(OC3=O)COS(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-])F

InChI

InChI=1S/C22H23FN2O7S/c23-21-12-16(9-10-20(21)15-5-2-1-3-6-15)24-13-18(32-22(24)26)14-31-33(29,30)19-8-4-7-17(11-19)25(27)28/h4,7-12,15,18H,1-3,5-6,13-14H2