(2R)-4-methylsulfonyl-2-pyrrol-1-yl-butanoic acid

Systemtic Name: (2R)-4-methylsulfonyl-2-pyrrol-1-yl-butanoic acid Openeye Name: (2R)-4-methylsulfonyl-2-pyrrol-1-yl-butanoic acid CAS Name: (2R)-4-methylsulfonyl-2-(1-pyrrolyl)butanoic acid IUPAC Name: (2R)-4-methylsulfonyl-2-pyrrol-1-ylbutanoic acid Traditional Name: (2R)-4-mesyl-2-pyrrol-1-yl-butyric acid Formula: C9H13NO4S MolecularWeight: 231.26882

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(C(=O)O)N1C=CC=C1

Isomeric SMILES

CS(=O)(=O)CC[C@H](C(=O)O)N1C=CC=C1

InChI

InChI=1S/C9H13NO4S/c1-15(13,14)7-4-8(9(11)12)10-5-2-3-6-10/h2-3,5-6,8H,4,7H2,1H3,(H,11,12)/t8-/m1/s1