2-[[2,4-bis(oxidanyl)phenyl]carbonylamino]-4-methylsulfonyl-butanoic acid

Systemtic Name: 2-[[2,4-bis(oxidanyl)phenyl]carbonylamino]-4-methylsulfonyl-butanoic acid Openeye Name: 2-[(2,4-dihydroxybenzoyl)amino]-4-methylsulfonyl-butanoic acid CAS Name: 2-[[(2,4-dihydroxyphenyl)-oxomethyl]amino]-4-methylsulfonylbutanoic acid IUPAC Name: 2-[(2,4-dihydroxybenzoyl)amino]-4-methylsulfonylbutanoic acid Traditional Name: 2-[(2,4-dihydroxybenzoyl)amino]-4-mesyl-butyric acid Formula: C12H15NO7S MolecularWeight: 317.315

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(C(=O)O)NC(=O)C1=C(C=C(C=C1)O)O

Isomeric SMILES

CS(=O)(=O)CCC(C(=O)O)NC(=O)C1=C(C=C(C=C1)O)O

InChI

InChI=1S/C12H15NO7S/c1-21(19,20)5-4-9(12(17)18)13-11(16)8-3-2-7(14)6-10(8)15/h2-3,6,9,14-15H,4-5H2,1H3,(H,13,16)(H,17,18)