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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1CCC2(C1)CC(CN2S(=O)(=O)C3=CC=CC=C3)S(=O)(=O)OC4=CC=CC=C4

Isomeric SMILES

CCOC1CCC2(C1)CC(CN2S(=O)(=O)C3=CC=CC=C3)S(=O)(=O)OC4=CC=CC=C4

InChI

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