(4-tert-butylphenyl) 4-pyrrolidin-1-ylsulfonylbenzenesulfonate

Systemtic Name: (4-tert-butylphenyl) 4-pyrrolidin-1-ylsulfonylbenzenesulfonate Openeye Name: (4-tert-butylphenyl) 4-pyrrolidin-1-ylsulfonylbenzenesulfonate CAS Name: 4-(1-pyrrolidinylsulfonyl)benzenesulfonic acid (4-tert-butylphenyl) ester IUPAC Name: (4-tert-butylphenyl) 4-pyrrolidin-1-ylsulfonylbenzenesulfonate Traditional Name: 4-pyrrolidinosulfonylbenzenesulfonic acid (4-tert-butylphenyl) ester Formula: C20H25NO5S2 MolecularWeight: 423.5462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C20H25NO5S2/c1-20(2,3)16-6-8-17(9-7-16)26-28(24,25)19-12-10-18(11-13-19)27(22,23)21-14-4-5-15-21/h6-13H,4-5,14-15H2,1-3H3