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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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