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

Systemtic Name: phenyl 9-chloranyl-7-iodanyl-9-azaspiro[4.4]nonane-3-sulfonate Openeye Name: phenyl 9-chloro-7-iodo-9-azaspiro[4.4]nonane-3-sulfonate CAS Name: 9-chloro-7-iodo-9-azaspiro[4.4]nonane-3-sulfonic acid phenyl ester IUPAC Name: phenyl 9-chloro-7-iodo-9-azaspiro[4.4]nonane-3-sulfonate Traditional Name: 9-chloro-7-iodo-9-azaspiro[4.4]nonane-3-sulfonic acid phenyl ester Formula: C14H17ClINO3S MolecularWeight: 441.71215

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CC1S(=O)(=O)OC3=CC=CC=C3)CC(CN2Cl)I

Isomeric SMILES

C1CC2(CC1S(=O)(=O)OC3=CC=CC=C3)CC(CN2Cl)I

InChI

InChI=1S/C14H17ClINO3S/c15-17-10-11(16)8-14(17)7-6-13(9-14)21(18,19)20-12-4-2-1-3-5-12/h1-5,11,13H,6-10H2