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

Systemtic Name: phenyl 7-iodanyl-3-(phenylsulfonyl)-9-azaspiro[4.4]nonane-9-sulfonate Openeye Name: phenyl 3-(benzenesulfonyl)-7-iodo-9-azaspiro[4.4]nonane-9-sulfonate CAS Name: 3-(benzenesulfonyl)-7-iodo-9-azaspiro[4.4]nonane-9-sulfonic acid phenyl ester IUPAC Name: phenyl 3-(benzenesulfonyl)-7-iodo-9-azaspiro[4.4]nonane-9-sulfonate Traditional Name: 3-besyl-7-iodo-9-azaspiro[4.4]nonane-9-sulfonic acid phenyl ester Formula: C20H22INO5S2 MolecularWeight: 547.42685

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CC1S(=O)(=O)C3=CC=CC=C3)CC(CN2S(=O)(=O)OC4=CC=CC=C4)I

Isomeric SMILES

C1CC2(CC1S(=O)(=O)C3=CC=CC=C3)CC(CN2S(=O)(=O)OC4=CC=CC=C4)I

InChI

InChI=1S/C20H22INO5S2/c21-16-13-20(22(15-16)29(25,26)27-17-7-3-1-4-8-17)12-11-19(14-20)28(23,24)18-9-5-2-6-10-18/h1-10,16,19H,11-15H2