phenyl 7-iodanyl-3-propan-2-ylsulfonyl-9-azaspiro[4.4]nonane-9-sulfonate

Systemtic Name: phenyl 7-iodanyl-3-propan-2-ylsulfonyl-9-azaspiro[4.4]nonane-9-sulfonate Openeye Name: phenyl 7-iodo-3-isopropylsulfonyl-9-azaspiro[4.4]nonane-9-sulfonate CAS Name: 7-iodo-3-propan-2-ylsulfonyl-9-azaspiro[4.4]nonane-9-sulfonic acid phenyl ester IUPAC Name: phenyl 7-iodo-3-propan-2-ylsulfonyl-9-azaspiro[4.4]nonane-9-sulfonate Traditional Name: 7-iodo-3-isopropylsulfonyl-9-azaspiro[4.4]nonane-9-sulfonic acid phenyl ester Formula: C17H24INO5S2 MolecularWeight: 513.41063

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1CCC2(C1)CC(CN2S(=O)(=O)OC3=CC=CC=C3)I

Isomeric SMILES

CC(C)S(=O)(=O)C1CCC2(C1)CC(CN2S(=O)(=O)OC3=CC=CC=C3)I

InChI

InChI=1S/C17H24INO5S2/c1-13(2)25(20,21)16-8-9-17(11-16)10-14(18)12-19(17)26(22,23)24-15-6-4-3-5-7-15/h3-7,13-14,16H,8-12H2,1-2H3