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

Systemtic Name: phenyl 10-(2-hydroxyphenyl)-4-(phenylsulfonyl)-11-azaspiro[5.5]undecane-11-sulfonate Openeye Name: phenyl 4-(benzenesulfonyl)-10-(2-hydroxyphenyl)-11-azaspiro[5.5]undecane-11-sulfonate CAS Name: 4-(benzenesulfonyl)-10-(2-hydroxyphenyl)-11-azaspiro[5.5]undecane-11-sulfonic acid phenyl ester IUPAC Name: phenyl 4-(benzenesulfonyl)-10-(2-hydroxyphenyl)-11-azaspiro[5.5]undecane-11-sulfonate Traditional Name: 4-besyl-10-(2-hydroxyphenyl)-11-azaspiro[5.5]undecane-11-sulfonic acid phenyl ester Formula: C28H31NO6S2 MolecularWeight: 541.67884

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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)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

C1CC(CC2(C1)CCCC(N2S(=O)(=O)OC3=CC=CC=C3)C4=CC=CC=C4O)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C28H31NO6S2/c30-27-18-8-7-16-25(27)26-17-10-20-28(29(26)37(33,34)35-22-11-3-1-4-12-22)19-9-15-24(21-28)36(31,32)23-13-5-2-6-14-23/h1-8,11-14,16,18,24,26,30H,9-10,15,17,19-21H2