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

Systemtic Name: phenyl 10-(2-hydroxyphenyl)-11-propan-2-ylsulfonyl-11-azaspiro[5.5]undecane-4-sulfonate Openeye Name: phenyl 10-(2-hydroxyphenyl)-11-isopropylsulfonyl-11-azaspiro[5.5]undecane-4-sulfonate CAS Name: 10-(2-hydroxyphenyl)-11-propan-2-ylsulfonyl-11-azaspiro[5.5]undecane-4-sulfonic acid phenyl ester IUPAC Name: phenyl 10-(2-hydroxyphenyl)-11-propan-2-ylsulfonyl-11-azaspiro[5.5]undecane-4-sulfonate Traditional Name: 10-(2-hydroxyphenyl)-11-isopropylsulfonyl-11-azaspiro[5.5]undecane-4-sulfonic acid phenyl ester Formula: C25H33NO6S2 MolecularWeight: 507.66262

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)N1C(CCCC12CCCC(C2)S(=O)(=O)OC3=CC=CC=C3)C4=CC=CC=C4O

Isomeric SMILES

CC(C)S(=O)(=O)N1C(CCCC12CCCC(C2)S(=O)(=O)OC3=CC=CC=C3)C4=CC=CC=C4O

InChI

InChI=1S/C25H33NO6S2/c1-19(2)33(28,29)26-23(22-13-6-7-15-24(22)27)14-9-17-25(26)16-8-12-21(18-25)34(30,31)32-20-10-4-3-5-11-20/h3-7,10-11,13,15,19,21,23,27H,8-9,12,14,16-18H2,1-2H3