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

Systemtic Name: phenyl 4,11-bis(2-hydroxyphenyl)-11-azaspiro[5.5]undecane-10-sulfonate Openeye Name: phenyl 4,11-bis(2-hydroxyphenyl)-11-azaspiro[5.5]undecane-10-sulfonate CAS Name: 4,11-bis(2-hydroxyphenyl)-11-azaspiro[5.5]undecane-10-sulfonic acid phenyl ester IUPAC Name: phenyl 4,11-bis(2-hydroxyphenyl)-11-azaspiro[5.5]undecane-10-sulfonate Traditional Name: 4,11-bis(2-hydroxyphenyl)-11-azaspiro[5.5]undecane-10-sulfonic acid phenyl ester Formula: C28H31NO5S MolecularWeight: 493.61444

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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)C5=CC=CC=C5O

Isomeric SMILES

C1CC(CC2(C1)CCCC(N2C3=CC=CC=C3O)S(=O)(=O)OC4=CC=CC=C4)C5=CC=CC=C5O

InChI

InChI=1S/C28H31NO5S/c30-25-15-6-4-13-23(25)21-10-8-18-28(20-21)19-9-17-27(29(28)24-14-5-7-16-26(24)31)35(32,33)34-22-11-2-1-3-12-22/h1-7,11-16,21,27,30-31H,8-10,17-20H2