1-[(2S)-1-(4-methylphenyl)sulfonyl-5-oxidanylidene-pyrrolidin-2-yl]carbonylpyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(2S)-1-(4-methylphenyl)sulfonyl-5-oxidanylidene-pyrrolidin-2-yl]carbonylpyrrolidine-2-carboxylic acid Openeye Name: 1-[(2S)-5-oxo-1-(p-tolylsulfonyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[[(2S)-1-(4-methylphenyl)sulfonyl-5-oxo-2-pyrrolidinyl]-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(2S)-1-(4-methylphenyl)sulfonyl-5-oxopyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(2S)-5-keto-1-tosyl-prolyl]proline Formula: C17H20N2O6S MolecularWeight: 380.4155

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(CCC2=O)C(=O)N3CCCC3C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2[C@@H](CCC2=O)C(=O)N3CCCC3C(=O)O

InChI

InChI=1S/C17H20N2O6S/c1-11-4-6-12(7-5-11)26(24,25)19-13(8-9-15(19)20)16(21)18-10-2-3-14(18)17(22)23/h4-7,13-14H,2-3,8-10H2,1H3,(H,22,23)/t13-,14?/m0/s1