2-[(2S)-1-(3-methylphenyl)sulfonylpyrrolidin-2-yl]ethanoate

Systemtic Name: 2-[(2S)-1-(3-methylphenyl)sulfonylpyrrolidin-2-yl]ethanoate Openeye Name: 2-[(2S)-1-(m-tolylsulfonyl)pyrrolidin-2-yl]acetate CAS Name: 2-[(2S)-1-(3-methylphenyl)sulfonyl-2-pyrrolidinyl]acetate IUPAC Name: 2-[(2S)-1-(3-methylphenyl)sulfonylpyrrolidin-2-yl]acetate Traditional Name: 2-[(2S)-1-(m-tolylsulfonyl)pyrrolidin-2-yl]acetate Formula: C13H16NO4S- MolecularWeight: 282.33544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)S(=O)(=O)N2CCCC2CC(=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)S(=O)(=O)N2CCC[C@H]2CC(=O)[O-]

InChI

InChI=1S/C13H17NO4S/c1-10-4-2-6-12(8-10)19(17,18)14-7-3-5-11(14)9-13(15)16/h2,4,6,8,11H,3,5,7,9H2,1H3,(H,15,16)/p-1/t11-/m0/s1