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

Systemtic Name: 2-[(2S)-1-(3-methylphenyl)sulfonylpyrrolidin-2-yl]ethanoic acid Openeye Name: 2-[(2S)-1-(m-tolylsulfonyl)pyrrolidin-2-yl]acetic acid CAS Name: 2-[(2S)-1-(3-methylphenyl)sulfonyl-2-pyrrolidinyl]acetic acid IUPAC Name: 2-[(2S)-1-(3-methylphenyl)sulfonylpyrrolidin-2-yl]acetic acid Traditional Name: 2-[(2S)-1-(m-tolylsulfonyl)pyrrolidin-2-yl]acetic acid Formula: C13H17NO4S MolecularWeight: 283.34338

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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)/t11-/m0/s1