[1-(2-fluoranylphenoxy)-2-oxidanyl-propyl] 4-methylbenzenesulfonate

Systemtic Name: [1-(2-fluoranylphenoxy)-2-oxidanyl-propyl] 4-methylbenzenesulfonate Openeye Name: [1-(2-fluorophenoxy)-2-hydroxy-propyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [1-(2-fluorophenoxy)-2-hydroxypropyl] ester IUPAC Name: [1-(2-fluorophenoxy)-2-hydroxypropyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [1-(2-fluorophenoxy)-2-hydroxy-propyl] ester Formula: C16H17FO5S MolecularWeight: 340.366583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC(C(C)O)OC2=CC=CC=C2F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC(C(C)O)OC2=CC=CC=C2F

InChI

InChI=1S/C16H17FO5S/c1-11-7-9-13(10-8-11)23(19,20)22-16(12(2)18)21-15-6-4-3-5-14(15)17/h3-10,12,16,18H,1-2H3