phenyl 11-fluoranyl-4-(2-hydroxyphenyl)-11-azaspiro[5.5]undecane-10-sulfonate

Systemtic Name: phenyl 11-fluoranyl-4-(2-hydroxyphenyl)-11-azaspiro[5.5]undecane-10-sulfonate Openeye Name: phenyl 11-fluoro-4-(2-hydroxyphenyl)-11-azaspiro[5.5]undecane-10-sulfonate CAS Name: 11-fluoro-4-(2-hydroxyphenyl)-11-azaspiro[5.5]undecane-10-sulfonic acid phenyl ester IUPAC Name: phenyl 11-fluoro-4-(2-hydroxyphenyl)-11-azaspiro[5.5]undecane-10-sulfonate Traditional Name: 11-fluoro-4-(2-hydroxyphenyl)-11-azaspiro[5.5]undecane-10-sulfonic acid phenyl ester Formula: C22H26FNO4S MolecularWeight: 419.509543

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC2(C1)CCCC(N2F)S(=O)(=O)OC3=CC=CC=C3)C4=CC=CC=C4O

Isomeric SMILES

C1CC(CC2(C1)CCCC(N2F)S(=O)(=O)OC3=CC=CC=C3)C4=CC=CC=C4O

InChI

InChI=1S/C22H26FNO4S/c23-24-21(29(26,27)28-18-9-2-1-3-10-18)13-7-15-22(24)14-6-8-17(16-22)19-11-4-5-12-20(19)25/h1-5,9-12,17,21,25H,6-8,13-16H2