diphenyl 3-oxidanyl-10-azaspiro[4.5]decane-6,10-disulfonate

Systemtic Name: diphenyl 3-oxidanyl-10-azaspiro[4.5]decane-6,10-disulfonate Openeye Name: diphenyl 3-hydroxy-10-azaspiro[4.5]decane-6,10-disulfonate CAS Name: 3-hydroxy-10-azaspiro[4.5]decane-6,10-disulfonic acid diphenyl ester IUPAC Name: diphenyl 3-hydroxy-10-azaspiro[4.5]decane-6,10-disulfonate Traditional Name: 3-hydroxy-10-azaspiro[4.5]decane-6,10-disulfonic acid diphenyl ester Formula: C21H25NO7S2 MolecularWeight: 467.5557

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2(CCC(C2)O)N(C1)S(=O)(=O)OC3=CC=CC=C3)S(=O)(=O)OC4=CC=CC=C4

Isomeric SMILES

C1CC(C2(CCC(C2)O)N(C1)S(=O)(=O)OC3=CC=CC=C3)S(=O)(=O)OC4=CC=CC=C4

InChI

InChI=1S/C21H25NO7S2/c23-17-13-14-21(16-17)20(30(24,25)28-18-8-3-1-4-9-18)12-7-15-22(21)31(26,27)29-19-10-5-2-6-11-19/h1-6,8-11,17,20,23H,7,12-16H2