phenyl 4,11-bis(propan-2-ylsulfonyl)-11-azaspiro[5.5]undecane-10-sulfonate

Systemtic Name: phenyl 4,11-bis(propan-2-ylsulfonyl)-11-azaspiro[5.5]undecane-10-sulfonate Openeye Name: phenyl 4,11-bis(isopropylsulfonyl)-11-azaspiro[5.5]undecane-10-sulfonate CAS Name: 4,11-bis(propan-2-ylsulfonyl)-11-azaspiro[5.5]undecane-10-sulfonic acid phenyl ester IUPAC Name: phenyl 4,11-bis(propan-2-ylsulfonyl)-11-azaspiro[5.5]undecane-10-sulfonate Traditional Name: 4,11-bis(isopropylsulfonyl)-11-azaspiro[5.5]undecane-10-sulfonic acid phenyl ester Formula: C22H35NO7S3 MolecularWeight: 521.7108

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1CCCC2(C1)CCCC(N2S(=O)(=O)C(C)C)S(=O)(=O)OC3=CC=CC=C3

Isomeric SMILES

CC(C)S(=O)(=O)C1CCCC2(C1)CCCC(N2S(=O)(=O)C(C)C)S(=O)(=O)OC3=CC=CC=C3

InChI

InChI=1S/C22H35NO7S3/c1-17(2)31(24,25)20-12-8-14-22(16-20)15-9-13-21(23(22)32(26,27)18(3)4)33(28,29)30-19-10-6-5-7-11-19/h5-7,10-11,17-18,20-21H,8-9,12-16H2,1-4H3