4-(3-methylsulfonyl-4-oxidanyl-5-oxidanylidene-2-phenyl-2H-pyrrol-1-yl)butanoic acid

Systemtic Name: 4-(3-methylsulfonyl-4-oxidanyl-5-oxidanylidene-2-phenyl-2H-pyrrol-1-yl)butanoic acid Openeye Name: 4-(4-hydroxy-3-methylsulfonyl-5-oxo-2-phenyl-2H-pyrrol-1-yl)butanoic acid CAS Name: 4-(4-hydroxy-3-methylsulfonyl-5-oxo-2-phenyl-2H-pyrrol-1-yl)butanoic acid IUPAC Name: 4-(4-hydroxy-3-methylsulfonyl-5-oxo-2-phenyl-2H-pyrrol-1-yl)butanoic acid Traditional Name: 4-(3-hydroxy-2-keto-4-mesyl-5-phenyl-3-pyrrolin-1-yl)butyric acid Formula: C15H17NO6S MolecularWeight: 339.36358

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C(=O)N(C1C2=CC=CC=C2)CCCC(=O)O)O

Isomeric SMILES

CS(=O)(=O)C1=C(C(=O)N(C1C2=CC=CC=C2)CCCC(=O)O)O

InChI

InChI=1S/C15H17NO6S/c1-23(21,22)14-12(10-6-3-2-4-7-10)16(15(20)13(14)19)9-5-8-11(17)18/h2-4,6-7,12,19H,5,8-9H2,1H3,(H,17,18)