diphenyl 9-ethoxy-9-azaspiro[4.4]nonane-3,7-disulfonate

Systemtic Name: diphenyl 9-ethoxy-9-azaspiro[4.4]nonane-3,7-disulfonate Openeye Name: diphenyl 9-ethoxy-9-azaspiro[4.4]nonane-3,7-disulfonate CAS Name: 9-ethoxy-9-azaspiro[4.4]nonane-3,7-disulfonic acid diphenyl ester IUPAC Name: diphenyl 9-ethoxy-9-azaspiro[4.4]nonane-3,7-disulfonate Traditional Name: 9-ethoxy-9-azaspiro[4.4]nonane-3,7-disulfonic acid diphenyl ester Formula: C22H27NO7S2 MolecularWeight: 481.58228

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Descriptors Computed from Structure

Canonical SMILES:

CCON1CC(CC12CCC(C2)S(=O)(=O)OC3=CC=CC=C3)S(=O)(=O)OC4=CC=CC=C4

Isomeric SMILES

CCON1CC(CC12CCC(C2)S(=O)(=O)OC3=CC=CC=C3)S(=O)(=O)OC4=CC=CC=C4

InChI

InChI=1S/C22H27NO7S2/c1-2-28-23-17-21(32(26,27)30-19-11-7-4-8-12-19)16-22(23)14-13-20(15-22)31(24,25)29-18-9-5-3-6-10-18/h3-12,20-21H,2,13-17H2,1H3