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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC2(C1)CCCC(N2O)C3=CC=CC=C3O)S(=O)(=O)OC4=CC=CC=C4

Isomeric SMILES

C1CC(CC2(C1)CCCC(N2O)C3=CC=CC=C3O)S(=O)(=O)OC4=CC=CC=C4

InChI

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