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

Systemtic Name: phenyl 11-(2-hydroxyphenyl)-4-iodanyl-11-azaspiro[5.5]undecane-10-sulfonate Openeye Name: phenyl 11-(2-hydroxyphenyl)-4-iodo-11-azaspiro[5.5]undecane-10-sulfonate CAS Name: 11-(2-hydroxyphenyl)-4-iodo-11-azaspiro[5.5]undecane-10-sulfonic acid phenyl ester IUPAC Name: phenyl 11-(2-hydroxyphenyl)-4-iodo-11-azaspiro[5.5]undecane-10-sulfonate Traditional Name: 11-(2-hydroxyphenyl)-4-iodo-11-azaspiro[5.5]undecane-10-sulfonic acid phenyl ester Formula: C22H26INO4S MolecularWeight: 527.41561

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC2(C1)CCCC(N2C3=CC=CC=C3O)S(=O)(=O)OC4=CC=CC=C4)I

Isomeric SMILES

C1CC(CC2(C1)CCCC(N2C3=CC=CC=C3O)S(=O)(=O)OC4=CC=CC=C4)I

InChI

InChI=1S/C22H26INO4S/c23-17-8-6-14-22(16-17)15-7-13-21(24(22)19-11-4-5-12-20(19)25)29(26,27)28-18-9-2-1-3-10-18/h1-5,9-12,17,21,25H,6-8,13-16H2