phenyl 7-ethoxy-3-(phenylsulfonyl)-9-azaspiro[4.4]nonane-9-sulfonate

Systemtic Name: phenyl 7-ethoxy-3-(phenylsulfonyl)-9-azaspiro[4.4]nonane-9-sulfonate Openeye Name: phenyl 3-(benzenesulfonyl)-7-ethoxy-9-azaspiro[4.4]nonane-9-sulfonate CAS Name: 3-(benzenesulfonyl)-7-ethoxy-9-azaspiro[4.4]nonane-9-sulfonic acid phenyl ester IUPAC Name: phenyl 3-(benzenesulfonyl)-7-ethoxy-9-azaspiro[4.4]nonane-9-sulfonate Traditional Name: 3-besyl-7-ethoxy-9-azaspiro[4.4]nonane-9-sulfonic acid phenyl ester Formula: C22H27NO6S2 MolecularWeight: 465.58288

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1CC2(CCC(C2)S(=O)(=O)C3=CC=CC=C3)N(C1)S(=O)(=O)OC4=CC=CC=C4

Isomeric SMILES

CCOC1CC2(CCC(C2)S(=O)(=O)C3=CC=CC=C3)N(C1)S(=O)(=O)OC4=CC=CC=C4

InChI

InChI=1S/C22H27NO6S2/c1-2-28-19-15-22(23(17-19)31(26,27)29-18-9-5-3-6-10-18)14-13-21(16-22)30(24,25)20-11-7-4-8-12-20/h3-12,19,21H,2,13-17H2,1H3