2-(2,3-dihydro-1,4-dioxin-5-ylcarbonylamino)-4-methylsulfonyl-butanoic acid

Systemtic Name: 2-(2,3-dihydro-1,4-dioxin-5-ylcarbonylamino)-4-methylsulfonyl-butanoic acid Openeye Name: 2-(2,3-dihydro-1,4-dioxine-5-carbonylamino)-4-methylsulfonyl-butanoic acid CAS Name: 2-[[2,3-dihydro-1,4-dioxin-5-yl(oxo)methyl]amino]-4-methylsulfonylbutanoic acid IUPAC Name: 2-(2,3-dihydro-1,4-dioxine-5-carbonylamino)-4-methylsulfonylbutanoic acid Traditional Name: 2-(2,3-dihydro-p-dioxin-5-carbonylamino)-4-mesyl-butyric acid Formula: C10H15NO7S MolecularWeight: 293.2936

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(C(=O)O)NC(=O)C1=COCCO1

Isomeric SMILES

CS(=O)(=O)CCC(C(=O)O)NC(=O)C1=COCCO1

InChI

InChI=1S/C10H15NO7S/c1-19(15,16)5-2-7(10(13)14)11-9(12)8-6-17-3-4-18-8/h6-7H,2-5H2,1H3,(H,11,12)(H,13,14)