(2S)-1-(2,4,5-trimethylphenyl)sulfonylpyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-(2,4,5-trimethylphenyl)sulfonylpyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-(2,4,5-trimethylphenyl)sulfonylpyrrolidine-2-carboxylic acid CAS Name: (2S)-1-(2,4,5-trimethylphenyl)sulfonyl-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-(2,4,5-trimethylphenyl)sulfonylpyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-(2,4,5-trimethylphenyl)sulfonylproline Formula: C14H19NO4S MolecularWeight: 297.36996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)S(=O)(=O)N2CCCC2C(=O)O)C

Isomeric SMILES

CC1=CC(=C(C=C1C)S(=O)(=O)N2CCC[C@H]2C(=O)O)C

InChI

InChI=1S/C14H19NO4S/c1-9-7-11(3)13(8-10(9)2)20(18,19)15-6-4-5-12(15)14(16)17/h7-8,12H,4-6H2,1-3H3,(H,16,17)/t12-/m0/s1