1-(4-tert-butylphenyl)sulfonylpyrrolidine-2-carboxylic acid

Systemtic Name: 1-(4-tert-butylphenyl)sulfonylpyrrolidine-2-carboxylic acid Openeye Name: 1-(4-tert-butylphenyl)sulfonylpyrrolidine-2-carboxylic acid CAS Name: 1-(4-tert-butylphenyl)sulfonyl-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(4-tert-butylphenyl)sulfonylpyrrolidine-2-carboxylic acid Traditional Name: 1-(4-tert-butylphenyl)sulfonylproline Formula: C15H21NO4S MolecularWeight: 311.39654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)O

InChI

InChI=1S/C15H21NO4S/c1-15(2,3)11-6-8-12(9-7-11)21(19,20)16-10-4-5-13(16)14(17)18/h6-9,13H,4-5,10H2,1-3H3,(H,17,18)