[2-(1-adamantyl)-4-methoxy-phenoxy] tris(fluoranyl)methanesulfonate

Systemtic Name: [2-(1-adamantyl)-4-methoxy-phenoxy] tris(fluoranyl)methanesulfonate Openeye Name: [2-(1-adamantyl)-4-methoxy-phenoxy] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [2-(1-adamantyl)-4-methoxyphenoxy] ester IUPAC Name: [2-(1-adamantyl)-4-methoxyphenoxy] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [2-(1-adamantyl)-4-methoxy-phenoxy] ester Formula: C18H21F3O5S MolecularWeight: 406.41655

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OOS(=O)(=O)C(F)(F)F)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

COC1=CC(=C(C=C1)OOS(=O)(=O)C(F)(F)F)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C18H21F3O5S/c1-24-14-2-3-16(25-26-27(22,23)18(19,20)21)15(7-14)17-8-11-4-12(9-17)6-13(5-11)10-17/h2-3,7,11-13H,4-6,8-10H2,1H3