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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC2(C1)CCCC(N2S(=O)(=O)OC3=CC=CC=C3)C4=CC=CC=C4O)O

Isomeric SMILES

C1CC(CC2(C1)CCCC(N2S(=O)(=O)OC3=CC=CC=C3)C4=CC=CC=C4O)O

InChI

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