diphenyl 11-(phenylmethyl)-11-azaspiro[5.5]undecane-4,10-disulfonate

Systemtic Name: diphenyl 11-(phenylmethyl)-11-azaspiro[5.5]undecane-4,10-disulfonate Openeye Name: diphenyl 11-benzyl-11-azaspiro[5.5]undecane-4,10-disulfonate CAS Name: 11-(phenylmethyl)-11-azaspiro[5.5]undecane-4,10-disulfonic acid diphenyl ester IUPAC Name: diphenyl 11-benzyl-11-azaspiro[5.5]undecane-4,10-disulfonate Traditional Name: 11-benzyl-11-azaspiro[5.5]undecane-4,10-disulfonic acid diphenyl ester Formula: C29H33NO6S2 MolecularWeight: 555.70542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC2(C1)CCCC(N2CC3=CC=CC=C3)S(=O)(=O)OC4=CC=CC=C4)S(=O)(=O)OC5=CC=CC=C5

Isomeric SMILES

C1CC(CC2(C1)CCCC(N2CC3=CC=CC=C3)S(=O)(=O)OC4=CC=CC=C4)S(=O)(=O)OC5=CC=CC=C5

InChI

InChI=1S/C29H33NO6S2/c31-37(32,35-25-14-6-2-7-15-25)27-18-10-20-29(22-27)21-11-19-28(30(29)23-24-12-4-1-5-13-24)38(33,34)36-26-16-8-3-9-17-26/h1-9,12-17,27-28H,10-11,18-23H2