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

Systemtic Name: phenyl 11-chloranyl-4-iodanyl-11-azaspiro[5.5]undecane-10-sulfonate Openeye Name: phenyl 11-chloro-4-iodo-11-azaspiro[5.5]undecane-10-sulfonate CAS Name: 11-chloro-4-iodo-11-azaspiro[5.5]undecane-10-sulfonic acid phenyl ester IUPAC Name: phenyl 11-chloro-4-iodo-11-azaspiro[5.5]undecane-10-sulfonate Traditional Name: 11-chloro-4-iodo-11-azaspiro[5.5]undecane-10-sulfonic acid phenyl ester Formula: C16H21ClINO3S MolecularWeight: 469.76531

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC2(C1)CCCC(N2Cl)S(=O)(=O)OC3=CC=CC=C3)I

Isomeric SMILES

C1CC(CC2(C1)CCCC(N2Cl)S(=O)(=O)OC3=CC=CC=C3)I

InChI

InChI=1S/C16H21ClINO3S/c17-19-15(23(20,21)22-14-7-2-1-3-8-14)9-5-11-16(19)10-4-6-13(18)12-16/h1-3,7-8,13,15H,4-6,9-12H2