2-[3-(furan-2-yl)propanoylamino]-4-methylsulfonyl-butanoic acid

Systemtic Name: 2-[3-(furan-2-yl)propanoylamino]-4-methylsulfonyl-butanoic acid Openeye Name: 2-[3-(2-furyl)propanoylamino]-4-methylsulfonyl-butanoic acid CAS Name: 2-[[3-(2-furanyl)-1-oxopropyl]amino]-4-methylsulfonylbutanoic acid IUPAC Name: 2-[3-(furan-2-yl)propanoylamino]-4-methylsulfonylbutanoic acid Traditional Name: 2-[3-(2-furyl)propanoylamino]-4-mesyl-butyric acid Formula: C12H17NO6S MolecularWeight: 303.33148

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(C(=O)O)NC(=O)CCC1=CC=CO1

Isomeric SMILES

CS(=O)(=O)CCC(C(=O)O)NC(=O)CCC1=CC=CO1

InChI

InChI=1S/C12H17NO6S/c1-20(17,18)8-6-10(12(15)16)13-11(14)5-4-9-3-2-7-19-9/h2-3,7,10H,4-6,8H2,1H3,(H,13,14)(H,15,16)