tert-butyl (2S)-pyrrolidine-2-carboxylate; N-(phenylsulfonyl)benzenesulfonamide

Systemtic Name: tert-butyl (2S)-pyrrolidine-2-carboxylate; N-(phenylsulfonyl)benzenesulfonamide Openeye Name: N-(benzenesulfonyl)benzenesulfonamide; tert-butyl (2S)-pyrrolidine-2-carboxylate CAS Name: N-(benzenesulfonyl)benzenesulfonamide; (2S)-2-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: N-(benzenesulfonyl)benzenesulfonamide; tert-butyl (2S)-pyrrolidine-2-carboxylate Traditional Name: N-besylbenzenesulfonamide; (2S)-pyrrolidine-2-carboxylic acid tert-butyl ester Formula: C21H28N2O6S2 MolecularWeight: 468.58682

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1CCCN1.C1=CC=C(C=C1)S(=O)(=O)NS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)[C@@H]1CCCN1.C1=CC=C(C=C1)S(=O)(=O)NS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C12H11NO4S2.C9H17NO2/c14-18(15,11-7-3-1-4-8-11)13-19(16,17)12-9-5-2-6-10-12;1-9(2,3)12-8(11)7-5-4-6-10-7/h1-10,13H;7,10H,4-6H2,1-3H3/t;7-/m.0/s1