phenyl 3,7-bis(2-hydroxyphenyl)-9-azaspiro[4.4]nonane-9-sulfonate

Systemtic Name: phenyl 3,7-bis(2-hydroxyphenyl)-9-azaspiro[4.4]nonane-9-sulfonate Openeye Name: phenyl 3,7-bis(2-hydroxyphenyl)-9-azaspiro[4.4]nonane-9-sulfonate CAS Name: 3,7-bis(2-hydroxyphenyl)-9-azaspiro[4.4]nonane-9-sulfonic acid phenyl ester IUPAC Name: phenyl 3,7-bis(2-hydroxyphenyl)-9-azaspiro[4.4]nonane-9-sulfonate Traditional Name: 3,7-bis(2-hydroxyphenyl)-9-azaspiro[4.4]nonane-9-sulfonic acid phenyl ester Formula: C26H27NO5S MolecularWeight: 465.56128

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CC1C3=CC=CC=C3O)CC(CN2S(=O)(=O)OC4=CC=CC=C4)C5=CC=CC=C5O

Isomeric SMILES

C1CC2(CC1C3=CC=CC=C3O)CC(CN2S(=O)(=O)OC4=CC=CC=C4)C5=CC=CC=C5O

InChI

InChI=1S/C26H27NO5S/c28-24-12-6-4-10-22(24)19-14-15-26(16-19)17-20(23-11-5-7-13-25(23)29)18-27(26)33(30,31)32-21-8-2-1-3-9-21/h1-13,19-20,28-29H,14-18H2