phenyl 4-iodanyl-11-methylsulfanyl-11-azaspiro[5.5]undecane-10-sulfonate

Systemtic Name: phenyl 4-iodanyl-11-methylsulfanyl-11-azaspiro[5.5]undecane-10-sulfonate Openeye Name: phenyl 4-iodo-11-methylsulfanyl-11-azaspiro[5.5]undecane-10-sulfonate CAS Name: 4-iodo-11-(methylthio)-11-azaspiro[5.5]undecane-10-sulfonic acid phenyl ester IUPAC Name: phenyl 4-iodo-11-methylsulfanyl-11-azaspiro[5.5]undecane-10-sulfonate Traditional Name: 4-iodo-11-(methylthio)-11-azaspiro[5.5]undecane-10-sulfonic acid phenyl ester Formula: C17H24INO3S2 MolecularWeight: 481.41183

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Descriptors Computed from Structure

Canonical SMILES:

CSN1C(CCCC12CCCC(C2)I)S(=O)(=O)OC3=CC=CC=C3

Isomeric SMILES

CSN1C(CCCC12CCCC(C2)I)S(=O)(=O)OC3=CC=CC=C3

InChI

InChI=1S/C17H24INO3S2/c1-23-19-16(24(20,21)22-15-8-3-2-4-9-15)10-6-12-17(19)11-5-7-14(18)13-17/h2-4,8-9,14,16H,5-7,10-13H2,1H3