1-(4-butan-2-ylphenyl)sulfonylpyrrolidine-2-carboxylic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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