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

Systemtic Name: phenyl 4-(2-hydroxyphenyl)-11-oxidanyl-11-azaspiro[5.5]undecane-10-sulfonate Openeye Name: phenyl 11-hydroxy-4-(2-hydroxyphenyl)-11-azaspiro[5.5]undecane-10-sulfonate CAS Name: 11-hydroxy-4-(2-hydroxyphenyl)-11-azaspiro[5.5]undecane-10-sulfonic acid phenyl ester IUPAC Name: phenyl 11-hydroxy-4-(2-hydroxyphenyl)-11-azaspiro[5.5]undecane-10-sulfonate Traditional Name: 11-hydroxy-4-(2-hydroxyphenyl)-11-azaspiro[5.5]undecane-10-sulfonic acid phenyl ester Formula: C22H27NO5S MolecularWeight: 417.51848

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC2(C1)CCCC(N2O)S(=O)(=O)OC3=CC=CC=C3)C4=CC=CC=C4O

Isomeric SMILES

C1CC(CC2(C1)CCCC(N2O)S(=O)(=O)OC3=CC=CC=C3)C4=CC=CC=C4O

InChI

InChI=1S/C22H27NO5S/c24-20-12-5-4-11-19(20)17-8-6-14-22(16-17)15-7-13-21(23(22)25)29(26,27)28-18-9-2-1-3-10-18/h1-5,9-12,17,21,24-25H,6-8,13-16H2