phenyl 7-iodanyl-9-oxidanyl-9-azaspiro[4.4]nonane-3-sulfonate

Systemtic Name: phenyl 7-iodanyl-9-oxidanyl-9-azaspiro[4.4]nonane-3-sulfonate Openeye Name: phenyl 9-hydroxy-7-iodo-9-azaspiro[4.4]nonane-3-sulfonate CAS Name: 9-hydroxy-7-iodo-9-azaspiro[4.4]nonane-3-sulfonic acid phenyl ester IUPAC Name: phenyl 9-hydroxy-7-iodo-9-azaspiro[4.4]nonane-3-sulfonate Traditional Name: 9-hydroxy-7-iodo-9-azaspiro[4.4]nonane-3-sulfonic acid phenyl ester Formula: C14H18INO4S MolecularWeight: 423.26649

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CC1S(=O)(=O)OC3=CC=CC=C3)CC(CN2O)I

Isomeric SMILES

C1CC2(CC1S(=O)(=O)OC3=CC=CC=C3)CC(CN2O)I

InChI

InChI=1S/C14H18INO4S/c15-11-8-14(16(17)10-11)7-6-13(9-14)21(18,19)20-12-4-2-1-3-5-12/h1-5,11,13,17H,6-10H2