[4-(4-fluoranyl-2-nitro-phenoxy)-1-oxidanyl-cyclohexyl] methanesulfonate

Systemtic Name: [4-(4-fluoranyl-2-nitro-phenoxy)-1-oxidanyl-cyclohexyl] methanesulfonate Openeye Name: [4-(4-fluoro-2-nitro-phenoxy)-1-hydroxy-cyclohexyl] methanesulfonate CAS Name: methanesulfonic acid [4-(4-fluoro-2-nitrophenoxy)-1-hydroxycyclohexyl] ester IUPAC Name: [4-(4-fluoro-2-nitrophenoxy)-1-hydroxycyclohexyl] methanesulfonate Traditional Name: methanesulfonic acid [4-(4-fluoro-2-nitro-phenoxy)-1-hydroxy-cyclohexyl] ester Formula: C13H16FNO7S MolecularWeight: 349.332043

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1(CCC(CC1)OC2=C(C=C(C=C2)F)[N+](=O)[O-])O

Isomeric SMILES

CS(=O)(=O)OC1(CCC(CC1)OC2=C(C=C(C=C2)F)[N+](=O)[O-])O

InChI

InChI=1S/C13H16FNO7S/c1-23(19,20)22-13(16)6-4-10(5-7-13)21-12-3-2-9(14)8-11(12)15(17)18/h2-3,8,10,16H,4-7H2,1H3