3-[1-(furan-2-ylmethylamino)-1-oxidanylidene-propan-2-yl]sulfonylpropanoic acid

Systemtic Name: 3-[1-(furan-2-ylmethylamino)-1-oxidanylidene-propan-2-yl]sulfonylpropanoic acid Openeye Name: 3-[2-(2-furylmethylamino)-1-methyl-2-oxo-ethyl]sulfonylpropanoic acid CAS Name: 3-[1-(2-furanylmethylamino)-1-oxopropan-2-yl]sulfonylpropanoic acid IUPAC Name: 3-[1-(furan-2-ylmethylamino)-1-oxopropan-2-yl]sulfonylpropanoic acid Traditional Name: 3-[2-(2-furfurylamino)-2-keto-1-methyl-ethyl]sulfonylpropionic acid Formula: C11H15NO6S MolecularWeight: 289.3049

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CO1)S(=O)(=O)CCC(=O)O

Isomeric SMILES

CC(C(=O)NCC1=CC=CO1)S(=O)(=O)CCC(=O)O

InChI

InChI=1S/C11H15NO6S/c1-8(19(16,17)6-4-10(13)14)11(15)12-7-9-3-2-5-18-9/h2-3,5,8H,4,6-7H2,1H3,(H,12,15)(H,13,14)